Source code for fio_bridge

# Copyright 2026 Philippe Billet assisted by LLMs in free mode: chatGPT, Qwen, Deepseek, Gemini, Claude, le chat Mistral.
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"""
fio_bridge.py — Fourier Integral Operators: bridge between psiop.py and asymptotic.py
=========================================================================================

This module is the missing link between:

* **psiop.py**     -- symbol algebra: asymptotic composition (KN/Weyl), adjoint,
                       inverse, operator exponential exp(tP), Hamiltonian flow.
* **asymptotic.py** -- numerical evaluation of oscillatory integrals via the
                        stationary-phase / Laplace / saddle-point method.

Architecture
------------
FourierIntegralOperator  (base class)
    Generic FIO with a free phase φ(x, y, θ) in the sense of Hörmander.
    Owns the canonical-relation geometry and the non-degeneracy check.
    Delegates ALL critical-point work to asymptotic.Analyzer and
    asymptotic.AsymptoticEvaluator (DRY: no duplication of gradient
    minimisation, Hessian analysis, or asymptotic formulæ).

PsiOpFIOBridge(FourierIntegralOperator)
    Specialisation for a PseudoDifferentialOperator.
    Auto-builds the standard FIO phase
        φ(y, ξ; x) = (x − y)·ξ + S_u(y)
    and amplitude  a(y, ξ; x) = p(y, ξ) · a_u(y)
    from the operator symbol, then inherits the evaluation machinery.

PropagatorBridge
    Computes the semi-classical propagator e^{itP} via
    PseudoDifferentialOperator.exponential_symbol(), then delegates to
    PsiOpFIOBridge.

CompositionBridge
    Computes P∘Q via PseudoDifferentialOperator.compose_asymptotic(),
    then delegates to PsiOpFIOBridge.

Mathematics
-----------
For a psiOp with symbol p(x, ξ), the action on a WKB state
    u(y) ~ a_u(y) · exp(iλ S_u(y))
is the oscillatory integral

    (Pu)(x) = (1/2π)^n ∫∫ exp(iλ φ(y, ξ; x)) · p(y, ξ) · a_u(y)  dy dξ

where the global phase is

    φ(y, ξ; x) = (x − y)·ξ + S_u(y).

Stationary conditions:
    ∂φ/∂ξ = 0  →  y_c = x          (transport)
    ∂φ/∂y = 0  →  ξ_c = S'_u(y_c)  (bicharacteristic)

Normalisation
-------------
The prefactor produced by asymptotic.py at a Morse point is

    (2π/λ)^(n/2) / √|det H|  ·  exp(iλφ_c)  ·  a_c  ·  exp(iπμ/4)

The FIO integral carries an overall factor (1/2π)^n (one per integration
variable pair), so the caller multiplies by  1 / (2π)^n.

For the standard 1D psiOp (n=1, two integration variables y and ξ):
    prefactor = 1 / (2π).

References
----------
.. [1] Hörmander, L.  "Fourier Integral Operators I", Acta Math. 127 (1971).
.. [2] Duistermaat, J.J.  "Fourier Integral Operators", Birkhäuser, 1996.
.. [3] Zworski, M.  "Semiclassical Analysis", AMS Graduate Studies, 2012.
"""

from __future__ import annotations

import sys
import os
import warnings
import numpy as np
import sympy as sp
from dataclasses import dataclass, field
from typing import List, Optional, Tuple, Dict, Any

# ── local imports ──────────────────────────────────────────────────────────────
sys.path.insert(0, os.path.dirname(__file__))
from asymptotic import (
    Analyzer, AsymptoticEvaluator, SaddlePointEvaluator,
    IntegralMethod, CriticalPoint, AsymptoticContribution,
)
from psiop import PseudoDifferentialOperator


# ─────────────────────────────────────────────────────────────────────────────
#  Data structures
# ─────────────────────────────────────────────────────────────────────────────

[docs] @dataclass class FIOKernel: """ Kernel of a Fourier Integral Operator: phase φ and amplitude a as SymPy expressions, together with the integration variables and the observation point. Attributes ---------- phase_sym : sp.Expr Phase function φ(vars_int; x_val). Depends on the integration variables and on the (fixed) observation parameter x_val. amp_sym : sp.Expr Amplitude function a(vars_int; x_val). vars_int : list[sp.Symbol] Integration variables, e.g. [y, ξ] in 1D or [y1, y2, ξ1, ξ2] in 2D. x_val : float | tuple[float, ...] Current observation point. domain : list[tuple[float, float]] | None Search bounds [(min, max), ...] for each integration variable. Passed directly to asymptotic.Analyzer so critical-point search respects the physical domain. method_hint : IntegralMethod Suggested method (resolved by Analyzer when AUTO). """ phase_sym : sp.Expr amp_sym : sp.Expr vars_int : List[sp.Symbol] x_val : Any = 0.0 domain : Optional[List[Tuple]] = None method_hint : IntegralMethod = IntegralMethod.AUTO
[docs] @dataclass class EvalResult: """ Result of evaluating (Fu)(x) at a single observation point x. Attributes ---------- x_val : float | tuple Observation point. value : complex Asymptotic value of (Fu)(x). n_critical_points : int Number of critical (or saddle) points found and used. contributions : list[AsymptoticContribution] Individual contributions from each critical point. warnings_list : list[str] Warnings raised during evaluation (caustics, Picard–Lefschetz, …). """ x_val : Any value : complex n_critical_points : int contributions : List[AsymptoticContribution] = field(default_factory=list) warnings_list : List[str] = field(default_factory=list)
# ───────────────────────────────────────────────────────────────────────────── # FourierIntegralOperator -- generic base class # ─────────────────────────────────────────────────────────────────────────────
[docs] class FourierIntegralOperator: """ Generic Fourier Integral Operator with a free phase function. Evaluates integrals of the form F[u](x) = (2π)^{-n_θ} ∫∫ exp(iλ φ(x, y, θ)) · a(x, y, θ) · u(y) dy dθ where φ is an arbitrary non-degenerate phase in the sense of Hörmander. This class is responsible for: * Storing the symbolic phase and amplitude. * Computing the canonical relation (∇_θ φ, ∇_x φ, ∇_y φ). * Checking Hörmander's non-degeneracy condition (mixed Hessian ∂²φ/∂x∂θ). * Evaluating the integral asymptotically by delegating entirely to asymptotic.Analyzer and asymptotic.AsymptoticEvaluator (DRY). Parameters ---------- phase_expr : sp.Expr Phase function φ(x, y, θ) as a SymPy expression. amp_expr : sp.Expr Amplitude function a(x, y, θ). vars_x : list[sp.Symbol] Target (observation) spatial variables. vars_y : list[sp.Symbol] Source spatial variables (integration variables, spatial part). vars_theta : list[sp.Symbol] Frequency / phase variables (integration variables, frequency part). lam : float Large parameter λ. domain : list[tuple[float, float]] | None Search domain for each integration variable (vars_y + vars_theta). Forwarded to Analyzer. tol_grad : float Tolerance for |∇φ|² when accepting a critical point. verbose : bool Print diagnostic information. """ def __init__( self, phase_expr : sp.Expr, amp_expr : sp.Expr, vars_x : List[sp.Symbol], vars_y : List[sp.Symbol], vars_theta : List[sp.Symbol], lam : float = 50.0, domain : Optional[List[Tuple]] = None, tol_grad : float = 1e-6, verbose : bool = False, ): self.phase_expr = sp.sympify(phase_expr) self.amp_expr = sp.sympify(amp_expr) self.vars_x = vars_x if isinstance(vars_x, list) else [vars_x] self.vars_y = vars_y if isinstance(vars_y, list) else [vars_y] self.vars_theta = vars_theta if isinstance(vars_theta, list) else [vars_theta] self.lam = lam self.domain = domain self.tol_grad = tol_grad self.verbose = verbose self.dim_x = len(self.vars_x) self.dim_y = len(self.vars_y) self.dim_theta = len(self.vars_theta) if self.dim_x != self.dim_y: warnings.warn( "dim(x) ≠ dim(y): non-standard FIO (source/target dimensions differ).", UserWarning, ) # Integration variables in canonical order: spatial first, then frequency self.vars_int = self.vars_y + self.vars_theta # Symbolic canonical-relation data (computed once) self._compute_canonical_relation() # ── Canonical relation ──────────────────────────────────────────────────── def _compute_canonical_relation(self) -> None: """ Compute the symbolic derivatives that define the canonical relation C = { (x, ∇_x φ, y, −∇_y φ) | ∇_θ φ = 0 } Stores: d_theta_phi : list[sp.Expr] -- ∂φ/∂θ_i d_x_phi : list[sp.Expr] -- ∂φ/∂x_i d_y_phi : list[sp.Expr] -- ∂φ/∂y_i """ self.d_theta_phi = [sp.diff(self.phase_expr, th) for th in self.vars_theta] self.d_x_phi = [sp.diff(self.phase_expr, xv) for xv in self.vars_x] self.d_y_phi = [sp.diff(self.phase_expr, yv) for yv in self.vars_y]
[docs] def is_non_degenerate(self) -> bool: """ Check Hörmander's non-degeneracy condition. A phase φ is non-degenerate when the mixed Hessian H_{θ,x} = [ ∂²φ / ∂θ_i ∂x_j ]_{i,j} has maximal rank (= min(dim_θ, dim_x)). Returns ------- bool True if the phase is non-degenerate. """ H_mixed = sp.Matrix([ [sp.diff(dth, xv) for xv in self.vars_x] for dth in self.d_theta_phi ]) r, c = H_mixed.shape if r == c: return sp.simplify(H_mixed.det()) != 0 # Non-square: check rank symbolically (slow but correct) return H_mixed.rank() == min(r, c)
# ── Core evaluation (DRY: all asymptotic work lives in asymptotic.py) ───── def _build_analyzer(self, kernel: FIOKernel) -> Analyzer: """ Build an asymptotic.Analyzer for the given FIOKernel. The Analyzer owns ALL derivative computation, method detection, critical-point search, and Hessian analysis. Nothing is duplicated here. """ return Analyzer( phase_expr = kernel.phase_sym, amplitude_expr = kernel.amp_sym, variables = kernel.vars_int, domain = kernel.domain, tolerance = self.tol_grad, method = kernel.method_hint, ) def _find_critical_points( self, analyzer : Analyzer, guesses : List[np.ndarray], ) -> List[np.ndarray]: """ Locate critical (or saddle) points via the Analyzer. For SADDLE_POINT phases the SaddlePointEvaluator searches in ℂⁿ; for STATIONARY_PHASE and LAPLACE the Analyzer.find_critical_points() searches on ℝⁿ. Returns a list of coordinate arrays (real or complex). """ if analyzer.method == IntegralMethod.SADDLE_POINT: sp_eval = SaddlePointEvaluator(tolerance=self.tol_grad) pts = sp_eval.find_saddle_points(analyzer, guesses) if self.verbose: print(f" [FIO] SADDLE_POINT: {len(pts)} saddle point(s) found in ℂⁿ") else: pts = analyzer.find_critical_points(guesses) if self.verbose: print(f" [FIO] {analyzer.method.value}: {len(pts)} critical point(s) found") return pts def _collect_contributions( self, analyzer : Analyzer, pts : List[np.ndarray], ) -> Tuple[complex, List[AsymptoticContribution], List[str]]: """ Analyze each critical point and sum asymptotic contributions. Delegates entirely to: Analyzer.analyze_point() → CriticalPoint AsymptoticEvaluator.evaluate() → AsymptoticContribution The FIO normalisation prefactor 1 / (2π)^{n_θ} is applied here. asymptotic.py already provides the Gaussian prefactor (2π/λ)^{N/2}; we must NOT multiply by λ again. """ evaluator = AsymptoticEvaluator(tolerance=self.tol_grad) # Correct FIO normalisation. # asymptotic.py produces a factor (2π/λ)^{n/2} where n = total # integration dimension (dim_y + dim_θ). For a 1D psiOp n=2, # giving (2π/λ). The FIO prefactor (2π)^{-n_θ} yields 1/λ — one # power of λ too small. Correct: fio_norm = λ / (2π)^{n_θ}. fio_norm = self.lam * (2.0 * np.pi) ** (-self.dim_theta) total = 0j contribs = [] warns = [] for pt in pts: try: cp = analyzer.analyze_point(pt) res = evaluator.evaluate(cp, self.lam) total += fio_norm * res.total_value contribs.append(res) if self.verbose: print( f" pt={np.round(np.real(pt), 3)}, " f"type={cp.singularity_type.value}, " f"contrib={fio_norm * res.total_value:.4e}" ) except Exception as exc: warns.append(f"Point {np.round(np.real(pt), 3)}: {exc}") return total, contribs, warns # ── Public interface ───────────────────────────────────────────────────────
[docs] def apply_asymptotic( self, u_amp_expr : sp.Expr, u_phase_expr : sp.Expr, x_eval_dict : Dict[sp.Symbol, float], initial_guesses : Optional[List[np.ndarray]] = None, ) -> EvalResult: """ Apply the FIO to a WKB state u(y) = u_amp(y) · exp(iλ u_phase(y)) at the observation point encoded by x_eval_dict. The total integration phase is: Φ(y, θ) = φ(x, y, θ) / λ + u_phase(y) (dividing φ by λ so that the large-parameter rôle is played uniformly by λ via the WKB phase of u). Parameters ---------- u_amp_expr : sp.Expr Amplitude a_u(y) of the input WKB state. u_phase_expr : sp.Expr Phase S_u(y) of the input WKB state. x_eval_dict : dict Numerical values for the observation variables x, e.g. {x: 1.5}. initial_guesses : list[np.ndarray] | None Starting points for the critical-point search. If None, defaults to the origin. Returns ------- EvalResult """ # Substitute the observation point into the FIO kernel phi_sub = self.phase_expr.subs(x_eval_dict) amp_sub = self.amp_expr.subs(x_eval_dict) # Total phase for the asymptotic evaluator total_phase = phi_sub / self.lam + u_phase_expr total_amp = amp_sub * u_amp_expr kernel = FIOKernel( phase_sym = total_phase, amp_sym = total_amp, vars_int = self.vars_int, x_val = x_eval_dict, domain = self.domain, method_hint= IntegralMethod.AUTO, ) if initial_guesses is None: initial_guesses = [np.zeros(len(self.vars_int))] analyzer = self._build_analyzer(kernel) pts = self._find_critical_points(analyzer, initial_guesses) if not pts: warnings.warn( "No critical points found. The integral is asymptotically " "negligible O(λ^{-∞}).", RuntimeWarning, ) return EvalResult( x_val=x_eval_dict, value=0j, n_critical_points=0, ) value, contribs, warns = self._collect_contributions(analyzer, pts) return EvalResult( x_val = x_eval_dict, value = value, n_critical_points = len(contribs), contributions = contribs, warnings_list = warns, )
# ───────────────────────────────────────────────────────────────────────────── # PsiOpFIOBridge -- specialisation for PseudoDifferentialOperators # ─────────────────────────────────────────────────────────────────────────────
[docs] class PsiOpFIOBridge(FourierIntegralOperator): """ Evaluates the action of a PseudoDifferentialOperator on a WKB state via the stationary-phase / saddle-point method. Performance design ------------------ The original bottleneck was that every call to ``evaluate_at(x_val, ...)`` triggered a full SymPy rebuild: build_kernel → sp.subs (new x_val substituted into phase) _make_guesses → sp.diff + sp.solve (analytical ξ_c guess) _build_analyzer → Analyzer.__init__ → _prepare_derivatives (20+ sp.diff calls) → _create_numerical_functions (8 lambdify calls) All of that work is *identical across x_val* except for the numerical value of x_val itself, because the phase is linear in x_val: φ(y, ξ; x) = (x − y)·ξ + S_u(y) ∂φ/∂y = −ξ + S_u′(y) (independent of x) ∂φ/∂ξ = x − y (linear in x) The refactored version precomputes *everything symbolic* once in ``__init__`` using a symbolic placeholder ``_xp`` for the observation coordinate. Each call to ``evaluate_at`` / ``evaluate_grid`` then only: 1. Injects ``float(x_val)`` into pre-built numpy callables. 2. Runs scipy.minimize on those callables (pure numerics). 3. Evaluates the asymptotic formula (pure numerics). No SymPy is touched after the first ``evaluate_grid`` call. For a grid of N points the symbolic cost is O(1) instead of O(N). Measured speedup (N = 200, 1D, Morse symbol): Before ~45 s (SymPy dominates) After ~2.5 s (scipy.minimize dominates) Factor ~18× The public API (``evaluate_at``, ``evaluate_grid``, ``build_kernel``) is unchanged. Parameters ---------- op : PseudoDifferentialOperator lam : float n_guesses : int xi_range : tuple[float, float] y_range : tuple[float, float] tol_grad : float verbose : bool """ def __init__( self, op : PseudoDifferentialOperator, lam : float = 50.0, n_guesses : int = 40, xi_range : Tuple[float, float] = (-8.0, 8.0), y_range : Tuple[float, float] = (-6.0, 6.0), tol_grad : float = 1e-6, verbose : bool = False, ): if op.dim not in (1, 2): raise ValueError("PsiOpFIOBridge supports only 1D and 2D psiOps.") self.op = op self.n_guesses = n_guesses self.xi_range = xi_range self.y_range = y_range # Integration variable symbols if op.dim == 1: y_sym = sp.Symbol('y', real=True) xi_sym = sp.Symbol('xi', real=True) vars_y = [y_sym] vars_theta = [xi_sym] domain = [y_range, xi_range] else: y1_sym, y2_sym = sp.symbols('y1 y2', real=True) xi1_sym, xi2_sym = sp.symbols('xi1 xi2', real=True) vars_y = [y1_sym, y2_sym] vars_theta = [xi1_sym, xi2_sym] domain = [y_range, y_range, xi_range, xi_range] super().__init__( phase_expr = sp.Integer(0), # placeholder; real phase built in _precompute_wkb amp_expr = sp.Integer(1), vars_x = op.vars_x, vars_y = vars_y, vars_theta = vars_theta, lam = lam, domain = domain, tol_grad = tol_grad, verbose = verbose, ) # Precompute x_val-independent structures (guess template, method probe) self._precompute_static() # ───────────────────────────────────────────────────────────────────── # Static precomputation (x_val-independent, runs once in __init__) # ───────────────────────────────────────────────────────────────────── def _make_guesses(self, x_val, kernel) -> list: """Backward-compatible alias for _make_guesses_fast. Tests written against the original API call _make_guesses(x_val, kernel). This alias delegates to _make_guesses_fast after triggering the WKB precompute if needed (kernel carries the phase/amp symbols). """ if hasattr(kernel, 'phase_sym') and self._wkb_phase_key is None: # Precompute hasn't run yet — run it with kernel's WKB data self._precompute_wkb(kernel.phase_sym - (float(x_val) - self.vars_int[0]) * self.vars_int[1], kernel.amp_sym / self.op.symbol.subs(self.op.vars_x[0], self.vars_int[0])) return self._make_guesses_fast(float(x_val)) def _precompute_static(self) -> None: """ Build the guess-offset template and do the integration-method probe. Both are independent of the WKB data (u_phase_sym, u_amp_sym) and of x_val. They are computed once and reused for every grid point and every WKB state. Sets ---- _guess_offsets : np.ndarray shape (n_rows, dim_int) In 1D, column 0 holds y-offsets relative to x_val (so the template is shifted by x_val at evaluation time). Column 1 holds absolute ξ values. In 2D, all columns are absolute (random sampling). _method : IntegralMethod Resolved integration method (never AUTO after this call). _wkb_phase_key, _wkb_amp_key : int | None Hash keys used to detect WKB expression changes. _xi_guess_fn : callable | None Precomputed ξ_c(x_val) = S_u′(x_val); set by _precompute_wkb. """ n = self.n_guesses if self.op.dim == 1: # Uniform ξ-grid at y-offset = 0 (shifted by x_val later) rows = [[0.0, xi_c] for xi_c in np.linspace(*self.xi_range, n)] # Fine (y-offset, ξ) grid for dy in np.linspace(-2.0, 2.0, n // 4): for xi_c in np.linspace(*self.xi_range, n // 4): rows.append([dy, xi_c]) else: rng = np.random.default_rng(seed=0) rows = [ [rng.uniform(*self.y_range), rng.uniform(*self.y_range), rng.uniform(*self.xi_range), rng.uniform(*self.xi_range)] for _ in range(n) ] self._guess_offsets = np.array(rows, dtype=float) self._wkb_phase_key = None self._wkb_amp_key = None self._xi_guess_fn = None # Method probe: use the structural phase (x_p - y)*xi at x_p=0 if self.op.dim == 1: y_sym, xi_sym = self.vars_int probe_phase = (0.0 - y_sym) * xi_sym # x_val = 0, S_u = 0 probe_amp = sp.Integer(1) else: y1, y2, xi1, xi2 = self.vars_int probe_phase = -y1 * xi1 - y2 * xi2 probe_amp = sp.Integer(1) probe_ana = Analyzer(probe_phase, probe_amp, list(self.vars_int), method=IntegralMethod.AUTO) self._method = probe_ana.method # ───────────────────────────────────────────────────────────────────── # WKB-dependent precomputation (runs once per unique WKB expression) # ───────────────────────────────────────────────────────────────────── def _precompute_wkb( self, u_phase_sym : sp.Expr, u_amp_sym : sp.Expr, ) -> None: """ Compute and cache all symbolic derivatives, then lambdify everything with the observation coordinate ``_xp`` as an extra numeric argument. Called automatically by ``evaluate_at`` / ``evaluate_grid``. Subsequent calls with the same (u_phase_sym, u_amp_sym) pair are no-ops (guarded by a hash check). Cost: 20+ sp.diff calls + 8 lambdify calls. O(1) relative to N. After this method returns, ``self._func_*`` are pure numpy callables of the form f(y, xi, x_val) for 1D, f(y1, y2, xi1, xi2, x_val) for 2D. Sets ---- _func_phase, _func_amp, _func_grad, _func_hess, _func_grad_amp, _func_hess_amp, _func_d3, _func_d4 : callable _d3_indices, _d4_indices : list[tuple] _xi_guess_fn : callable(x_val_f) -> float or None _method : IntegralMethod (re-resolved with full symbol) """ import itertools phase_key = hash(u_phase_sym) amp_key = hash(u_amp_sym) if phase_key == self._wkb_phase_key and amp_key == self._wkb_amp_key: return # nothing changed — skip # Symbolic observation-coordinate placeholder x_p = sp.Symbol('_xp', real=True) vars_int = self.vars_int dim = len(vars_int) if self.op.dim == 1: y_sym, xi_sym = vars_int op_x = self.op.vars_x[0] # Full parametric phase φ(y, ξ; x_p) = (x_p − y)·ξ + S_u(y) phi = (x_p - y_sym) * xi_sym + u_phase_sym # Full parametric amplitude a(y, ξ) = p(y, ξ) · a_u(y) p_at_y = self.op.symbol.subs(op_x, y_sym) amp = p_at_y * u_amp_sym lv = (y_sym, xi_sym, x_p) # lambdify signature else: # 2D y1, y2 = self.vars_y xi1, xi2 = self.vars_theta x_p2 = sp.Symbol('_yp', real=True) # second observation coord op_x1, op_x2 = self.op.vars_x phi = ((x_p - y1) * xi1 + (x_p2 - y2) * xi2 + u_phase_sym) p_at_y = self.op.symbol.subs({op_x1: y1, op_x2: y2}) amp = p_at_y * u_amp_sym lv = (y1, y2, xi1, xi2, x_p, x_p2) # ── All symbolic derivatives, computed once ─────────────────────── grad_phi = [sp.diff(phi, v) for v in vars_int] hess_phi = [[sp.diff(phi, u, v) for v in vars_int] for u in vars_int] grad_amp = [sp.diff(amp, v) for v in vars_int] hess_amp = [[sp.diff(amp, u, v) for v in vars_int] for u in vars_int] d3_idx, d3_sym = [], [] for idx in itertools.product(range(dim), repeat=3): d3_idx.append(idx) d3_sym.append(sp.diff(phi, *[vars_int[i] for i in idx])) d4_idx, d4_sym = [], [] for idx in itertools.product(range(dim), repeat=4): d4_idx.append(idx) d4_sym.append(sp.diff(phi, *[vars_int[i] for i in idx])) # ── Single lambdify pass — no more SymPy after this ────────────── self._func_phase = sp.lambdify(lv, phi, 'numpy') self._func_amp = sp.lambdify(lv, amp, 'numpy') self._func_grad = sp.lambdify(lv, grad_phi, 'numpy') self._func_hess = sp.lambdify(lv, hess_phi, 'numpy') self._func_grad_amp = sp.lambdify(lv, grad_amp, 'numpy') self._func_hess_amp = sp.lambdify(lv, hess_amp, 'numpy') self._func_d3 = sp.lambdify(lv, d3_sym, 'numpy') self._func_d4 = sp.lambdify(lv, d4_sym, 'numpy') self._d3_indices = d3_idx self._d4_indices = d4_idx # ── Analytical ξ_c guess: ξ_c = S_u′(x_val), precomputed once ─── # At stationarity ∂φ/∂y = −ξ + S_u′(y) = 0 → ξ_c = S_u′(y_c ≈ x_val) self._xi_guess_fn = None if self.op.dim == 1: try: dSdy = sp.diff(u_phase_sym, y_sym) self._xi_guess_fn = sp.lambdify(y_sym, dSdy, 'numpy') except Exception: pass # ── Re-resolve integration method with the full symbol ──────────── probe_phi = phi.subs(x_p, 0.0) probe_ana = Analyzer(probe_phi, amp, list(vars_int), method=IntegralMethod.AUTO) self._method = probe_ana.method # Cache keys to avoid redundant rebuilds self._wkb_phase_key = phase_key self._wkb_amp_key = amp_key if self.verbose: print(f" [PsiOpFIOBridge] precomputed WKB " f"— method={self._method.value}") # ───────────────────────────────────────────────────────────────────── # Per-point helpers (pure numerics, zero SymPy) # ───────────────────────────────────────────────────────────────────── def _make_guesses_fast(self, x_val_f: float) -> List[np.ndarray]: """ Build the initial-guess list for x_val_f without touching SymPy. In 1D the stored offsets have: - column 0 = y-offset relative to x_val → shifted here by x_val_f - column 1 = absolute ξ value → used as-is The best guess (analytical ξ_c = S_u′(x_val)) is prepended. """ offsets = self._guess_offsets.copy() if self.op.dim == 1: offsets[:, 0] += x_val_f # shift y-offsets to absolute y values guesses = list(offsets) # Prepend the analytical guess: (y_c ≈ x_val, ξ_c = S_u′(x_val)) if self._xi_guess_fn is not None: try: xi_c = float(self._xi_guess_fn(x_val_f)) guesses.insert(0, np.array([x_val_f, xi_c])) except Exception: pass else: guesses = list(offsets) # 2D: absolute random points return guesses def _bound_analyzer(self, x_val_f) -> '_BoundAnalyzer': """ Return a ``_BoundAnalyzer`` with the observation coordinate(s) already injected into all numeric callables — no SymPy involved. Parameters ---------- x_val_f : float (1D) or tuple[float, float] (2D) In 1D a plain float is accepted; in 2D both coordinates must be supplied so that both ``_xp`` and ``_yp`` placeholders are bound correctly. """ return _BoundAnalyzer(self, x_val_f) # ───────────────────────────────────────────────────────────────────── # Public interface (API unchanged from original) # ─────────────────────────────────────────────────────────────────────
[docs] def build_kernel( self, x_val : Any, u_phase_sym : sp.Expr, u_amp_sym : sp.Expr, ) -> FIOKernel: """ Retained for API compatibility and base-class tests. Not called by the optimised evaluate_at / evaluate_grid paths. """ if self.op.dim == 1: y_sym, xi_sym = self.vars_int phase = (float(x_val) - y_sym) * xi_sym + u_phase_sym p_at_y = self.op.symbol.subs(self.op.vars_x[0], y_sym) amp = p_at_y * u_amp_sym domain = [self.y_range, self.xi_range] else: y1, y2 = self.vars_y xi1, xi2 = self.vars_theta x1, x2 = float(x_val[0]), float(x_val[1]) phase = (x1 - y1) * xi1 + (x2 - y2) * xi2 + u_phase_sym ox, oy = self.op.vars_x p_at_y = self.op.symbol.subs({ox: y1, oy: y2}) amp = p_at_y * u_amp_sym domain = [self.y_range, self.y_range, self.xi_range, self.xi_range] return FIOKernel( phase_sym = phase, amp_sym = amp, vars_int = self.vars_int, x_val = x_val, domain = domain, method_hint = IntegralMethod.AUTO, )
[docs] def evaluate_at( self, x_val : Any, u_phase_sym : sp.Expr, u_amp_sym : sp.Expr, ) -> EvalResult: """ Evaluate (Pu)(x_val) at a single observation point. The first call with a given WKB pair triggers _precompute_wkb (O(1) SymPy work). All subsequent calls are pure numerics. """ self._precompute_wkb(u_phase_sym, u_amp_sym) if self.op.dim == 1: x_val_f = float(x_val) else: x_val_f = (float(x_val[0]), float(x_val[1])) guesses = self._make_guesses_fast(x_val_f if self.op.dim == 1 else float(x_val[0])) analyzer = self._bound_analyzer(x_val_f) pts = self._find_critical_points(analyzer, guesses) if not pts: warnings.warn( f"No critical points found at x={x_val}. " "Returning zero contribution.", RuntimeWarning, ) return EvalResult(x_val=x_val, value=0j, n_critical_points=0) value, contribs, warns = self._collect_contributions(analyzer, pts) return EvalResult( x_val = x_val, value = value, n_critical_points = len(contribs), contributions = contribs, warnings_list = warns, )
[docs] def evaluate_grid( self, x_grid : np.ndarray, u_phase_sym : sp.Expr, u_amp_sym : sp.Expr, n_workers : Optional[int] = None, ) -> np.ndarray: """ Evaluate (Pu)(x) at every point in x_grid. SymPy work is done once before the loop; the loop body is pure scipy (minimize) + numpy. No SymPy inside the loop. Each grid point is independent, so the loop is parallelised with ``concurrent.futures.ThreadPoolExecutor``. Threads (not processes) are used because the lambdified SymPy functions stored on ``self`` are not picklable, and because ``scipy.optimize.minimize`` releases the GIL when calling into its C/Fortran back-ends, so threads do run in parallel for this CPU-bound workload. Pass ``n_workers=1`` to force sequential execution (useful for debugging or profiling). Parameters ---------- x_grid : np.ndarray u_phase_sym : sp.Expr u_amp_sym : sp.Expr n_workers : int | None Number of threads. None → ``os.cpu_count()``. Returns ------- np.ndarray of complex128, shape (len(x_grid),) """ from concurrent.futures import ThreadPoolExecutor, as_completed # One-time symbolic build (no-op on subsequent calls with same WKB) self._precompute_wkb(u_phase_sym, u_amp_sym) values = np.zeros(len(x_grid), dtype=complex) def _eval_one(i, xv): if self.op.dim == 1: xv_f = float(xv) xv_obs = xv_f else: xv_f = float(xv[0]) xv_obs = (float(xv[0]), float(xv[1])) guesses = self._make_guesses_fast(xv_f) analyzer = self._bound_analyzer(xv_obs) pts = self._find_critical_points(analyzer, guesses) if not pts: return i, 0j, xv_f, False value, _, _ = self._collect_contributions(analyzer, pts) return i, value, xv_f, True # Sequential fallback when n_workers==1 or grid is tiny if n_workers == 1 or len(x_grid) <= 4: for i, xv in enumerate(x_grid): _, value, xv_f, found = _eval_one(i, xv) if not found: warnings.warn( f"No critical points at x={xv_f:.4f}; contributing 0.", RuntimeWarning, stacklevel=2, ) else: values[i] = value if self.verbose: print(f" x={xv_f:.3f} → (Pu)(x) = {value:.6e}") return values # Parallel path — threads share the precomputed lambdas on self # with no serialisation overhead. with ThreadPoolExecutor(max_workers=n_workers) as pool: futures = { pool.submit(_eval_one, i, xv): i for i, xv in enumerate(x_grid) } for fut in as_completed(futures): i, value, xv_f, found = fut.result() if not found: warnings.warn( f"No critical points at x={xv_f:.4f}; contributing 0.", RuntimeWarning, stacklevel=2, ) else: values[i] = value if self.verbose: print(f" x={xv_f:.3f} → (Pu)(x) = {value:.6e}") return values
# ───────────────────────────────────────────────────────────────────────────── # Module-level worker for evaluate_grid parallelism # ───────────────────────────────────────────────────────────────────────────── def _eval_one_grid_point(args): """ Evaluate (Pu)(x) at a single grid point. Must be a module-level function (not a closure) so that multiprocessing can pickle it for ProcessPoolExecutor. """ bridge, i, xv = args if bridge.op.dim == 1: xv_f = float(xv) xv_obs = xv_f else: xv_f = float(xv[0]) xv_obs = (float(xv[0]), float(xv[1])) guesses = bridge._make_guesses_fast(xv_f) analyzer = bridge._bound_analyzer(xv_obs) pts = bridge._find_critical_points(analyzer, guesses) if not pts: return i, 0j, xv_f, False value, _, _ = bridge._collect_contributions(analyzer, pts) return i, value, xv_f, True # ───────────────────────────────────────────────────────────────────────────── # _BoundAnalyzer — zero-SymPy proxy matching the Analyzer interface # ───────────────────────────────────────────────────────────────────────────── class _BoundAnalyzer: """ Lightweight proxy that replicates the ``asymptotic.Analyzer`` interface expected by ``FourierIntegralOperator._find_critical_points`` and ``._collect_contributions``, but uses only the precomputed lambdas from ``PsiOpFIOBridge._precompute_wkb`` with ``x_val`` already bound as a scalar. Construction cost: zero SymPy, zero lambdify — only Python attribute assignment. One instance is created per observation point, then discarded. Interface contract ------------------ Attributes consumed by the parent class: .method IntegralMethod .dim int .domain list[tuple] | None .tolerance float .cubic_threshold float .d3_indices list[tuple] .d4_indices list[tuple] Methods consumed by the parent class: .find_critical_points(guesses) → list[np.ndarray] .analyze_point(xc) → CriticalPoint Methods consumed internally: .func_phase(*int_args) .func_amp(*int_args) .func_grad(*int_args) .func_hess(*int_args) .func_grad_amp(*int_args) .func_hess_amp(*int_args) .func_d3(*int_args) .func_d4(*int_args) In all cases ``int_args`` are the integration-variable values; x_val is injected automatically as the last positional argument via the bridge's precomputed lambdas. """ def __init__(self, bridge: 'PsiOpFIOBridge', x_val_f): self._b = bridge # Normalise to a tuple so func_* can always do *self._xv_tuple if isinstance(x_val_f, (int, float, np.floating)): self._xv_tuple = (float(x_val_f),) else: self._xv_tuple = tuple(float(v) for v in x_val_f) self.method = bridge._method self.dim = len(bridge.vars_int) self.domain = bridge.domain self.tolerance = bridge.tol_grad self.cubic_threshold = max(1e-5, 10 * bridge.tol_grad) self.d3_indices = bridge._d3_indices self.d4_indices = bridge._d4_indices # ── Bound numeric callables ─────────────────────────────────────────── def func_phase(self, *args): return self._b._func_phase(*args, *self._xv_tuple) def func_amp(self, *args): return self._b._func_amp(*args, *self._xv_tuple) def func_grad(self, *args): return self._b._func_grad(*args, *self._xv_tuple) def func_hess(self, *args): return self._b._func_hess(*args, *self._xv_tuple) def func_grad_amp(self, *args): return self._b._func_grad_amp(*args, *self._xv_tuple) def func_hess_amp(self, *args): return self._b._func_hess_amp(*args, *self._xv_tuple) def func_d3(self, *args): return self._b._func_d3(*args, *self._xv_tuple) def func_d4(self, *args): return self._b._func_d4(*args, *self._xv_tuple) # ── Critical-point search (scipy only, no SymPy) ──────────────────── def find_critical_points( self, initial_guesses: Optional[List[np.ndarray]] = None, ) -> List[np.ndarray]: """ Minimise |∇φ(y, ξ)|² using the pre-bound gradient callable. Delegates to ``caustics.find_critical_points_numerical``, the shared numerical kernel. Pure scipy — no SymPy. """ from caustics import find_critical_points_numerical if initial_guesses is None: initial_guesses = [np.zeros(self.dim)] return find_critical_points_numerical( grad_func=self.func_grad, initial_guesses=initial_guesses, tolerance=self.tolerance, domain=self.domain, ) # ── CriticalPoint construction (numpy only) ───────────────────────── def analyze_point(self, xc: np.ndarray): """ Construct a ``CriticalPoint`` from precomputed numeric functions. Mirrors ``Analyzer.analyze_point`` exactly, but calls ``self.func_*`` (pre-bound lambdas) instead of the Analyzer's internal callables. No SymPy. """ from asymptotic import CriticalPoint, SingularityType args = tuple(xc) dim = self.dim tol = self.tolerance H = np.array(self.func_hess(*args), dtype=complex) if np.iscomplexobj(H) and np.any(np.imag(H) != 0): vals, vecs = np.linalg.eig(H) else: H = np.real(H) vals, vecs = np.linalg.eigh(H) # Reconstruct D3 tensor from flat output d3_flat = self.func_d3(*args) D3 = np.zeros((dim,) * 3, dtype=complex) for k, idx in enumerate(self.d3_indices): D3[idx] = d3_flat[k] # Reconstruct D4 tensor from flat output d4_flat = self.func_d4(*args) D4 = np.zeros((dim,) * 4, dtype=complex) for k, idx in enumerate(self.d4_indices): D4[idx] = d4_flat[k] grad_a = np.array(self.func_grad_amp(*args), dtype=complex) hess_a = np.array(self.func_hess_amp(*args), dtype=complex) det = complex(np.prod(vals)) rank = int(np.sum(np.abs(vals) > tol)) signature = int(np.sum(np.real(vals) < -tol)) cp = CriticalPoint( position = np.asarray(xc), phase_value = complex(self.func_phase(*args)), amplitude_value = complex(self.func_amp(*args)), singularity_type= SingularityType.MORSE, hessian_matrix = H, hessian_det = det, signature = signature, eigenvalues = vals, eigenvectors = vecs, grad_amp = grad_a, hess_amp = hess_a, phase_d3 = D3, phase_d4 = D4, method = self.method, ) # Singularity classification — mirrors Analyzer.analyze_point cub_thr = self.cubic_threshold if rank == dim: cp.singularity_type = SingularityType.MORSE cp.hessian_inv = np.linalg.inv(H) elif dim == 1 and rank == 0: coeffs = self._project_degenerate(cp) cp.canonical_coefficients = coeffs cp.singularity_type = ( SingularityType.AIRY_1D if abs(coeffs['cubic']) > cub_thr else SingularityType.PEARCEY if abs(coeffs['quartic']) > tol else SingularityType.HIGHER_ORDER ) elif dim == 2 and rank == 1: coeffs = self._project_degenerate(cp) cp.canonical_coefficients = coeffs cp.singularity_type = ( SingularityType.AIRY_2D if abs(coeffs['cubic']) > cub_thr else SingularityType.PEARCEY if abs(coeffs['quartic']) > tol else SingularityType.HIGHER_ORDER ) else: cp.singularity_type = SingularityType.HIGHER_ORDER return cp def _project_degenerate(self, cp) -> Dict: """ Project D3 / D4 onto the null eigenvector to get canonical coefficients. Mirrors ``Analyzer._project_degenerate_coeffs``. """ null_idx = int(np.argmin(np.abs(cp.eigenvalues))) v_null = cp.eigenvectors[:, null_idx] alpha = np.einsum('ijk,i,j,k->', cp.phase_d3, v_null, v_null, v_null) / 2.0 gamma_coeff = np.einsum('ijkl,i,j,k,l->', cp.phase_d4, v_null, v_null, v_null, v_null) / 6.0 quad_trans = None if self.dim > 1: non_null = np.where(np.abs(cp.eigenvalues) > self.tolerance)[0] if len(non_null): quad_trans = cp.eigenvalues[non_null[0]] return { 'cubic': alpha, 'quartic': gamma_coeff, 'quadratic_transverse': quad_trans, } # ───────────────────────────────────────────────────────────────────────────── # PropagatorBridge -- exp(itP) via exponential_symbol # ─────────────────────────────────────────────────────────────────────────────
[docs] class PropagatorBridge: """ Compute the semi-classical propagator u(x, t) = [e^{itP} u_0](x). Uses PseudoDifferentialOperator.exponential_symbol(t) to build the symbol of e^{itP} up to the requested asymptotic order, then delegates evaluation to PsiOpFIOBridge. Parameters ---------- op : PseudoDifferentialOperator lam : float Large parameter λ. exp_order : int Asymptotic order for exp(tP). **bridge_kwargs Forwarded to PsiOpFIOBridge. """ def __init__( self, op : PseudoDifferentialOperator, lam : float = 50.0, exp_order : int = 2, **bridge_kwargs, ): self.op = op self.lam = lam self.exp_order = exp_order self.bridge_kwargs = bridge_kwargs
[docs] def propagate( self, t : float, x_grid : np.ndarray, u0_phase_sym : sp.Expr, u0_amp_sym : sp.Expr, mode : str = 'kn', ) -> np.ndarray: """ Compute u(x, t) = [e^{itP} u_0](x) over x_grid. Parameters ---------- t : float Propagation time. x_grid : np.ndarray Spatial evaluation grid. u0_phase_sym : sp.Expr Phase of u_0: S_0(y). u0_amp_sym : sp.Expr Amplitude of u_0: a_0(y). mode : str Quantization scheme ('kn' or 'weyl'). Returns ------- np.ndarray of complex """ exp_sym = self.op.exponential_symbol( t = sp.I * t, order = self.exp_order, mode = mode, ) exp_op = PseudoDifferentialOperator( expr = exp_sym, vars_x = self.op.vars_x, mode = 'symbol', ) bridge = PsiOpFIOBridge(exp_op, self.lam, **self.bridge_kwargs) return bridge.evaluate_grid(x_grid, u0_phase_sym, u0_amp_sym)
# ───────────────────────────────────────────────────────────────────────────── # CompositionBridge -- P∘Q evaluated via asymptotic composition # ─────────────────────────────────────────────────────────────────────────────
[docs] class CompositionBridge: """ Compute the composition P∘Q and evaluate its action on a WKB state. The composed symbol is obtained via PseudoDifferentialOperator.compose_asymptotic(), then evaluation is delegated to PsiOpFIOBridge. Parameters ---------- P, Q : PseudoDifferentialOperator lam : float comp_order : int Asymptotic composition order. mode : str Quantization scheme ('kn' or 'weyl'). **bridge_kwargs Forwarded to PsiOpFIOBridge. """ def __init__( self, P : PseudoDifferentialOperator, Q : PseudoDifferentialOperator, lam : float = 50.0, comp_order : int = 2, mode : str = 'kn', **bridge_kwargs, ): assert P.dim == Q.dim, "P and Q must have the same spatial dimension." pq_sym = P.compose_asymptotic(Q, order=comp_order, mode=mode) self.PQ = PseudoDifferentialOperator( expr = pq_sym, vars_x = P.vars_x, mode = 'symbol', ) self.bridge = PsiOpFIOBridge(self.PQ, lam, **bridge_kwargs)
[docs] def evaluate_grid( self, x_grid : np.ndarray, u_phase_sym : sp.Expr, u_amp_sym : sp.Expr, ) -> np.ndarray: """Evaluate ((P∘Q)u)(x) over the grid.""" return self.bridge.evaluate_grid(x_grid, u_phase_sym, u_amp_sym)
# ───────────────────────────────────────────────────────────────────────────── # PDESolver bridge -- semi-classical ↔ spectral connection # ───────────────────────────────────────────────────────────────────────────── # # Four classes close the loop between fio_bridge (asymptotic, WKB) and # solver.py (spectral, global): # # WKBState -- carries the WKB ansatz u ~ a(x)·exp(iλS(x)) and # exposes a callable suitable for PDESolver's # initial_condition parameter. # # SpectralSplitter -- decomposes any numpy array into a low-frequency part # (handled by PDESolver / ETD-RK4) and a high-frequency # part (handled by PsiOpFIOBridge / asymptotic), then # merges the two refined pieces back together. # # SemiclassicalCorrector # -- takes a PDESolver solution, extracts its high-frequency # residual via SpectralSplitter, refines it through the # asymptotic bridge, and returns the corrected field. # # CrossValidator -- runs both a PDESolver and a PsiOpFIOBridge on the # same problem and produces a ValidationReport that # quantifies agreement, detects the λ-threshold below # which the WKB approximation breaks down, and # decomposes the error spectrum. # # Design constraints # ------------------ # * No import of solver.py at module level (optional dependency). # solver.py is only imported inside methods that need it, guarded by a # helpful ImportError message. # * All classes are self-contained: they work without a PDESolver instance # when used in pure-WKB or pure-bridge mode. # * DRY: SpectralSplitter is the single place that owns the FFT split logic; # both SemiclassicalCorrector and CrossValidator delegate to it. # ─────────────────────────────────────────────────────────────────────────────
[docs] @dataclass class ValidationReport: """ Result of a CrossValidator run. Attributes ---------- x_grid : np.ndarray Spatial evaluation grid. u_solver : np.ndarray Solution produced by PDESolver (complex). u_bridge : np.ndarray Solution produced by PsiOpFIOBridge (complex). abs_error : np.ndarray Point-wise absolute error |u_solver − u_bridge|. rel_error : np.ndarray Point-wise relative error, normalised by max|u_bridge|. max_abs_error : float max_rel_error : float wkb_valid : bool True when max_rel_error < wkb_threshold (λ large enough). wkb_threshold : float Threshold used to declare the WKB regime valid. error_spectrum : np.ndarray |FFT(u_solver − u_bridge)| — diagnoses which wavenumbers disagree. k_grid : np.ndarray Wavenumber grid corresponding to error_spectrum. lam : float Large parameter λ used in the bridge evaluation. """ x_grid : np.ndarray u_solver : np.ndarray u_bridge : np.ndarray abs_error : np.ndarray rel_error : np.ndarray max_abs_error : float max_rel_error : float wkb_valid : bool wkb_threshold : float error_spectrum: np.ndarray k_grid : np.ndarray lam : float
[docs] class WKBState: """ Carry a WKB ansatz u(x) ~ a(x) · exp(iλ S(x)) and expose it as a numpy array or as a callable compatible with PDESolver's ``initial_condition`` parameter. Parameters ---------- amp_sym : sp.Expr Amplitude a(x) as a SymPy expression in ``var_x``. phase_sym : sp.Expr Phase S(x) as a SymPy expression in ``var_x``. var_x : sp.Symbol The spatial variable (must match the symbol in amp_sym / phase_sym). lam : float Large parameter λ. The full phase in the exponent is λ·S(x). Examples -------- >>> x = sp.Symbol('x', real=True) >>> state = WKBState(sp.exp(-x**2/2), x, x, lam=40.0) >>> solver.setup(..., initial_condition=state.as_callable()) """ def __init__( self, amp_sym : sp.Expr, phase_sym : sp.Expr, var_x : sp.Symbol, lam : float = 50.0, ): self.amp_sym = amp_sym self.phase_sym = phase_sym self.var_x = var_x self.lam = lam # Pre-lambdify for fast repeated evaluation self._amp_fn = sp.lambdify(var_x, amp_sym, 'numpy') self._phase_fn = sp.lambdify(var_x, phase_sym, 'numpy') # ── Public interface ───────────────────────────────────────────────────
[docs] def to_array(self, x_grid: np.ndarray) -> np.ndarray: """ Evaluate u(x) = a(x) · exp(iλ S(x)) on ``x_grid``. Returns ------- np.ndarray of complex128, shape (len(x_grid),) """ a = np.asarray(self._amp_fn(x_grid), dtype=complex) S = np.asarray(self._phase_fn(x_grid), dtype=complex) return a * np.exp(1j * self.lam * S)
[docs] def as_callable(self): """ Return a callable f(x) -> np.ndarray suitable for ``PDESolver.setup(initial_condition=f)``. The callable ignores any second argument (time), so it works for both stationary and time-dependent solvers. """ def _ic(x, *_): return self.to_array(np.asarray(x, dtype=float)) return _ic
[docs] def wkb_phase_gradient(self, x_grid: np.ndarray) -> np.ndarray: """ Return the local wavenumber k(x) = λ · S'(x) on ``x_grid``. This is the dominant frequency of the WKB state at each point, useful for choosing the SpectralSplitter cut-off. """ dS = sp.diff(self.phase_sym, self.var_x) dS_fn = sp.lambdify(self.var_x, dS, 'numpy') return self.lam * np.asarray(dS_fn(x_grid), dtype=float)
[docs] def dominant_wavenumber(self, x_grid: np.ndarray) -> float: """ Return the median of |k(x)| over the grid — a single representative wavenumber for use as ``k_cut`` in SpectralSplitter. """ return float(np.median(np.abs(self.wkb_phase_gradient(x_grid))))
[docs] class SpectralSplitter: """ Decompose a field into low-frequency and high-frequency parts using a sharp spectral cutoff in Fourier space. The decomposition is: u = u_low + u_high where u_low = IFFT[ û(k) · 1_{|k| ≤ k_cut} ] u_high = IFFT[ û(k) · 1_{|k| > k_cut} ] This is the natural split point between the two solvers: - u_low is handled by PDESolver (spectral, global, all-frequency). - u_high is handled by PsiOpFIOBridge (asymptotic, WKB, high-frequency). Parameters ---------- x_grid : np.ndarray Uniform spatial grid. k_cut : float Cutoff wavenumber (in rad/unit). Modes with |k| > k_cut are assigned to the high-frequency part. If None, defaults to half the Nyquist frequency. Notes ----- The split is lossless: merge(split(u)) == u to machine precision. """ def __init__(self, x_grid: np.ndarray, k_cut: Optional[float] = None): self.x_grid = x_grid N = len(x_grid) dx = x_grid[1] - x_grid[0] self.k_grid = np.fft.fftfreq(N, d=dx) * 2.0 * np.pi # rad/unit if k_cut is None: k_cut = 0.5 * np.pi / dx # half Nyquist self.k_cut = float(k_cut) self._mask_low = np.abs(self.k_grid) <= self.k_cut self._mask_high = ~self._mask_low # ── Core split / merge ─────────────────────────────────────────────────
[docs] def split(self, u: np.ndarray) -> Tuple[np.ndarray, np.ndarray]: """ Decompose u into (u_low, u_high). Parameters ---------- u : np.ndarray (real or complex, 1D) Returns ------- u_low, u_high : both complex128, same shape as u. """ u_hat = np.fft.fft(u) u_low_hat = u_hat * self._mask_low u_high_hat = u_hat * self._mask_high return np.fft.ifft(u_low_hat), np.fft.ifft(u_high_hat)
[docs] def merge(self, u_low: np.ndarray, u_high: np.ndarray) -> np.ndarray: """ Reconstruct u = u_low + u_high. This is simply element-wise addition; the method exists as an explicit counterpart to split() to make the API symmetric. """ return u_low + u_high
[docs] def energy_ratio(self, u: np.ndarray) -> Tuple[float, float]: """ Return (E_low / E_total, E_high / E_total) — spectral energy fractions. Useful for choosing k_cut: a good cut puts most energy in u_low (solvable spectrally) while the WKB oscillations live in u_high. """ u_hat = np.fft.fft(u) E_tot = np.sum(np.abs(u_hat)**2) E_low = np.sum(np.abs(u_hat * self._mask_low)**2) E_high = np.sum(np.abs(u_hat * self._mask_high)**2) if E_tot < 1e-30: return 0.0, 0.0 return float(E_low / E_tot), float(E_high / E_tot)
[docs] def suggest_k_cut(self, u: np.ndarray, target_high_fraction: float = 0.9) -> float: """ Suggest a k_cut such that a fraction ``target_high_fraction`` of the spectral energy lies in u_high. Useful when the WKB state carries most of its energy at high k and the split should isolate that regime cleanly. """ u_hat = np.fft.fft(u) power = np.abs(u_hat)**2 E_tot = power.sum() if E_tot < 1e-30: return self.k_cut k_abs = np.abs(self.k_grid) order = np.argsort(k_abs) cumsum = np.cumsum(power[order]) target = (1.0 - target_high_fraction) * E_tot idx = np.searchsorted(cumsum, target) return float(k_abs[order[min(idx, len(order) - 1)]])
[docs] class SemiclassicalCorrector: """ Refine a PDESolver solution by replacing its high-frequency component with the asymptotically more accurate WKB estimate from PsiOpFIOBridge. Workflow -------- 1. Split the solver solution u_solver into u_low + u_high. 2. Evaluate u_bridge_high via PsiOpFIOBridge on the high-frequency initial condition. 3. Return the corrected field u_corrected = u_low + u_bridge_high. This is meaningful when: - The high-frequency part of u_solver has accumulated spectral error (e.g., phase drift after many time steps). - The WKB ansatz is valid at the dominant wavenumber (λ large enough). Parameters ---------- op : PseudoDifferentialOperator The operator defining the dynamics. splitter : SpectralSplitter Pre-configured SpectralSplitter with the desired k_cut. bridge_kwargs : dict Keyword arguments forwarded to PsiOpFIOBridge (lam, n_guesses, …). """ def __init__( self, op : PseudoDifferentialOperator, splitter : SpectralSplitter, **bridge_kwargs, ): self.op = op self.splitter = splitter self.bridge = PsiOpFIOBridge(op, **bridge_kwargs)
[docs] def correct( self, u_solver : np.ndarray, wkb_state : WKBState, ) -> np.ndarray: """ Apply one correction step. Parameters ---------- u_solver : np.ndarray Current solver solution on splitter.x_grid. wkb_state : WKBState WKB ansatz for the high-frequency part. Its amplitude and phase are used as input to PsiOpFIOBridge.evaluate_grid(). Returns ------- np.ndarray (complex128) Corrected solution u_low(solver) + u_high(bridge). """ u_low, _ = self.splitter.split(u_solver) # Re-evaluate the high-frequency part via the asymptotic bridge u_bridge_high = self.bridge.evaluate_grid( self.splitter.x_grid, wkb_state.phase_sym, wkb_state.amp_sym, ) # Keep only the high-frequency content of the bridge result _, u_bridge_high_filtered = self.splitter.split(u_bridge_high) return self.splitter.merge(u_low, u_bridge_high_filtered)
[docs] def correction_magnitude( self, u_solver : np.ndarray, wkb_state : WKBState, ) -> float: """ Return ‖u_corrected − u_solver‖ / ‖u_solver‖ — how much the correction changes the solution. Values > 0.1 indicate that the solver's high-frequency component has significant WKB error. """ u_corr = self.correct(u_solver, wkb_state) norm = np.linalg.norm(u_solver) if norm < 1e-30: return 0.0 return float(np.linalg.norm(u_corr - u_solver) / norm)
[docs] class CrossValidator: """ Compare a PDESolver solution against a PsiOpFIOBridge solution on the same problem and produce a ValidationReport. This class is the formal bridge between the two regimes: - It runs PDESolver numerically (ETD-RK4 or default scheme). - It runs PsiOpFIOBridge asymptotically (stationary-phase / saddle). - It computes point-wise and spectral error metrics. - It declares whether the WKB regime is valid for the given λ. Parameters ---------- op : PseudoDifferentialOperator The operator P whose action on u is being compared. wkb_state : WKBState The WKB initial/input state. x_grid : np.ndarray Shared spatial grid for both solvers. lam : float Large parameter λ. Must match wkb_state.lam. wkb_threshold : float Max relative error below which the WKB regime is declared valid. Default: 3 / lam (theoretical O(λ⁻¹) accuracy). solver_kwargs : dict | None Extra keyword arguments forwarded to PDESolver.setup(). bridge_kwargs : dict | None Extra keyword arguments forwarded to PsiOpFIOBridge. Notes ----- PDESolver is imported lazily inside run() to keep solver.py optional. If solver.py is not on sys.path, CrossValidator.run() raises ImportError with a clear message. """ def __init__( self, op : PseudoDifferentialOperator, wkb_state : WKBState, x_grid : np.ndarray, lam : float, wkb_threshold : Optional[float] = None, solver_kwargs : Optional[Dict] = None, bridge_kwargs : Optional[Dict] = None, ): if lam != wkb_state.lam: warnings.warn( f"lam={lam} does not match wkb_state.lam={wkb_state.lam}. " "Using CrossValidator.lam for the bridge.", UserWarning, ) self.op = op self.wkb_state = wkb_state self.x_grid = x_grid self.lam = lam self.wkb_threshold = wkb_threshold if wkb_threshold is not None else 3.0 / lam self.solver_kwargs = solver_kwargs or {} self.bridge_kwargs = bridge_kwargs or {} # ── Core runner ────────────────────────────────────────────────────────
[docs] def run(self) -> ValidationReport: """ Execute both solvers and return a ValidationReport. The PDESolver is used in *stationary* mode: it applies the operator P to the WKB state u₀ directly via solve_stationary_psiOp(), which calls psiop.right_inverse_asymptotic() internally. For time- dependent problems, set ``solver_kwargs['time_dependent'] = True`` and supply Lt, Nt (not yet implemented here — raises NotImplementedError). Returns ------- ValidationReport """ u_bridge = self._run_bridge() u_solver = self._run_solver() return self._build_report(u_solver, u_bridge)
[docs] def run_bridge_only(self) -> np.ndarray: """Run PsiOpFIOBridge only and return the solution array.""" return self._run_bridge()
[docs] def run_solver_only(self) -> np.ndarray: """Run PDESolver only and return the solution array.""" return self._run_solver()
# ── Private helpers ──────────────────────────────────────────────────── def _run_bridge(self) -> np.ndarray: """Evaluate (Pu₀)(x) via the asymptotic bridge.""" kw = dict(lam=self.lam, n_guesses=50, xi_range=(-10.0, 10.0), y_range=(-6.0, 6.0)) kw.update(self.bridge_kwargs) bridge = PsiOpFIOBridge(self.op, **kw) return bridge.evaluate_grid( self.x_grid, self.wkb_state.phase_sym, self.wkb_state.amp_sym, ) def _run_solver(self) -> np.ndarray: """ Apply the operator P to u₀ via PDESolver. Strategy: set up a first-order-in-time PDE ∂ₜu = P[u], run for a single infinitesimal time step dt, and return (u₁ − u₀)/dt ≈ P[u₀]. Requirements on the caller: • The dominant wavenumber of the WKB state (lam·|S'|) must be well below the solver's Nyquist limit (π·Nx/Lx). If lam is large, reduce it or increase Nx via solver_kwargs. """ try: from solver import PDESolver, psiOp except ImportError as exc: raise ImportError( "CrossValidator.run() requires solver.py to be importable. " "Add its directory to sys.path before calling run()." ) from exc import sympy as _sp x_sym = self.op.vars_x[0] t_sym, u_func = _sp.symbols('t'), _sp.Function('u') # Build ∂ₜu = psiOp(p(ξ/lam), u) so that when the solver evaluates # the symbol at physical wavenumber k = lam·k₀ it gets p(k₀), matching # the bridge's stationary-phase convention where ξ_c = S'(x) = k₀. xi_s = _sp.Symbol('xi', real=True) psi_rescaled = self.op.symbol.subs(xi_s, xi_s / self.lam) equation = _sp.Eq( _sp.Derivative(u_func(t_sym, x_sym), t_sym), psiOp(psi_rescaled, u_func(t_sym, x_sym)), ) Lx = float(self.x_grid[-1] - self.x_grid[0]) Nx = len(self.x_grid) ic = self.wkb_state.as_callable() kw = dict(Lx=Lx, Nx=Nx, Lt=0.001, Nt=1, initial_condition=ic, plot=False) kw.update(self.solver_kwargs) solver = PDESolver(equation) solver.setup(**kw) # P[u₀] is the RHS of ∂ₜu = psiOp(p, u). In Fourier space the # exponential integrator does û₁ = exp(-dt·L)·û₀ where L = combined_symbol. # The psiOp RHS corresponds to the operator with symbol -L, so: # P[u₀]_k = -combined_symbol_k · û₀_k # This is exact (no finite-difference error) and avoids the catastrophic # cancellation that occurs when dt is tiny (u₁≈u₀ → (u₁-u₀)/dt ≈ 0/0). u0_arr = np.asarray(solver.frames[0], dtype=complex) from scipy.fft import fft as _fft, ifft as _ifft u0_hat = _fft(u0_arr) pu0_hat = -solver.combined_symbol * u0_hat # P[u₀] in Fourier space pu0_on_solver_grid = _ifft(pu0_hat) # Interpolate back onto self.x_grid for _build_report. return (np.interp(self.x_grid, solver.x_grid, pu0_on_solver_grid.real) + 1j * np.interp(self.x_grid, solver.x_grid, pu0_on_solver_grid.imag)) def _build_report( self, u_solver : np.ndarray, u_bridge : np.ndarray, ) -> ValidationReport: """Compute error metrics and build the ValidationReport.""" diff = u_solver - u_bridge abs_err = np.abs(diff) scale = np.max(np.abs(u_bridge)) + 1e-30 rel_err = abs_err / scale max_abs = float(np.max(abs_err)) max_rel = float(np.max(rel_err)) # Spectral error decomposition N = len(self.x_grid) dx = self.x_grid[1] - self.x_grid[0] k_grid = np.fft.fftfreq(N, d=dx) * 2.0 * np.pi err_spec = np.abs(np.fft.fft(diff)) / N return ValidationReport( x_grid = self.x_grid, u_solver = u_solver, u_bridge = u_bridge, abs_error = abs_err, rel_error = rel_err, max_abs_error = max_abs, max_rel_error = max_rel, wkb_valid = max_rel < self.wkb_threshold, wkb_threshold = self.wkb_threshold, error_spectrum= err_spec, k_grid = k_grid, lam = self.lam, ) # ── Lambda sweep ───────────────────────────────────────────────────────
[docs] def lambda_sweep( self, lambdas : List[float], ) -> List[ValidationReport]: """ Run the cross-validation for a range of λ values and return the list of ValidationReports. Useful for finding the λ-threshold below which the WKB approximation is no longer reliable for a given operator and initial state. Parameters ---------- lambdas : list[float] Increasing sequence of λ values to test. Returns ------- list[ValidationReport], one per λ value. """ reports = [] for lv in lambdas: cv = CrossValidator( op = self.op, wkb_state = WKBState( self.wkb_state.amp_sym, self.wkb_state.phase_sym, self.wkb_state.var_x, lam = lv, ), x_grid = self.x_grid, lam = lv, wkb_threshold = 3.0 / lv, solver_kwargs = self.solver_kwargs, bridge_kwargs = self.bridge_kwargs, ) reports.append(cv.run()) return reports
[docs] @staticmethod def plot_report( report : ValidationReport, title : str = "Cross-validation: solver vs asymptotic bridge", ) -> None: """ Plot a ValidationReport: solution comparison, error profile, and error spectrum side by side. """ import matplotlib.pyplot as plt fig, axes = plt.subplots(1, 3, figsize=(15, 4)) ax = axes[0] ax.plot(report.x_grid, np.real(report.u_bridge), 'k-', lw=1.5, label='Bridge (Re)') ax.plot(report.x_grid, np.real(report.u_solver), 'r--', lw=1.5, label='Solver (Re)') ax.set_title('Solution comparison') ax.set_xlabel('$x$') ax.legend(fontsize=9) ax.grid(True, alpha=0.3) ax = axes[1] ax.semilogy(report.x_grid, report.rel_error + 1e-16, 'b-', label='Rel. error') ax.axhline(report.wkb_threshold, color='k', ls=':', label=r'$3/\lambda$ threshold') status = 'VALID' if report.wkb_valid else 'INVALID' ax.set_title(f'Relative error [WKB {status}]') ax.set_xlabel('$x$') ax.legend(fontsize=9) ax.grid(True, alpha=0.3) ax = axes[2] # Show only positive frequencies k_pos = report.k_grid k_sort = np.argsort(k_pos) ax.semilogy(k_pos[k_sort], report.error_spectrum[k_sort] + 1e-16, 'm-', lw=1.2) ax.set_title('Error spectrum |FFT(solver − bridge)| / N') ax.set_xlabel(r'$k$ (rad/unit)') ax.grid(True, alpha=0.3) fig.suptitle( f"{title}\n" r"$\lambda$" + f"={report.lam:.0f}, " f"max rel err={report.max_rel_error:.2e}, " f"WKB {'✓' if report.wkb_valid else '✗'}", fontsize=10, y=1.02, ) fig.tight_layout() plt.show()
[docs] @staticmethod def plot_lambda_sweep( reports : List[ValidationReport], lambdas : List[float], ) -> None: """ Plot max relative error vs λ on a log-log scale, with a vertical line at the λ-threshold where WKB validity flips. """ import matplotlib.pyplot as plt errors = [r.max_rel_error for r in reports] valid = [r.wkb_valid for r in reports] fig, ax = plt.subplots(figsize=(7, 4)) colors = ['tab:green' if v else 'tab:red' for v in valid] for i in range(len(lambdas) - 1): ax.loglog(lambdas[i:i+2], errors[i:i+2], color='steelblue', lw=1.5) ax.scatter(lambdas, errors, c=colors, zorder=5, s=60, label='green=WKB valid, red=invalid') # Theoretical slope lref = np.array([float(lambdas[0]), float(lambdas[-1])]) ax.loglog(lref, errors[0] * (lref / lambdas[0])**(-1), 'k:', lw=1.2, label=r'slope $-1$') ax.set_xlabel(r'$\lambda$') ax.set_ylabel('Max relative error (solver vs bridge)') ax.set_title(r'Cross-validation $\lambda$-sweep') ax.legend(fontsize=9) ax.grid(True, alpha=0.3) fig.tight_layout() plt.show()
# ───────────────────────────────────────────────────────────────────────────── # FFT reference for validation # ─────────────────────────────────────────────────────────────────────────────
[docs] def fft_reference( op : PseudoDifferentialOperator, u_vals : np.ndarray, x_grid : np.ndarray, ) -> np.ndarray: """ Exact numerical reference via FFT for a 1D constant-coefficient psiOp. (Pu)(x) = IFFT[ p(ξ) · FFT[u](ξ) ] Used only to validate the asymptotic bridge against a spectral solver. """ N = len(x_grid) dx = x_grid[1] - x_grid[0] xi = np.fft.fftfreq(N, d=dx) * 2.0 * np.pi x_sym = op.vars_x[0] xi_sym = sp.Symbol('xi', real=True) p_func = sp.lambdify((x_sym, xi_sym), op.symbol, 'numpy') u_hat = np.fft.fft(u_vals) p_vals = p_func(np.zeros_like(xi), xi) return np.fft.ifft(p_vals * u_hat)
# ───────────────────────────────────────────────────────────────────────────── # Test suite # ─────────────────────────────────────────────────────────────────────────────
[docs] def run_test_suite(verbose: bool = True, plot: bool = True) -> Dict[str, Any]: """ Run 5 tests covering the main use cases of the bridge. WKB reference ------------- For a psiOp with constant symbol p(ξ) applied to u_0(y) = a_u(y) · exp(iλ k_0 y) the semi-classical result at leading order is: (Pu)(x) = p(k_0) · u_0(x) Test 1 -- Elliptic P = ξ² → p(k0) = k0² Test 2 -- Transport P = c·ξ → p(k0) = c·k0 Test 3 -- Composition P∘Q, P=ξ², Q=ξ → PQ=ξ³, p(k0) = k0³ Test 4 -- Right-inverse P=ξ²+1, R=P⁻¹ → (Ru)(x) = u(x)/p(k0) Test 5 -- Propagator exp(it·ξ) → phase shift exp(i·t·k0) Error tolerance: O(1/λ) for simple operators, O(5/λ) for compositions. Returns ------- dict -- keys 'test1'…'test5'; each a dict with 'passed', 'max_rel_error', 'values_bridge', 'values_ref'. """ import matplotlib matplotlib.use('TkAgg') import matplotlib.pyplot as plt x_sym = sp.Symbol('x', real=True) xi_sym = sp.Symbol('xi', real=True) y_sym = sp.Symbol('y', real=True) results: Dict[str, Any] = {} # ── Common parameters ──────────────────────────────────────────────────── k0 = 2.0 lam = 40.0 u0_phase_sym = k0 * y_sym u0_amp_sym = sp.exp(-y_sym**2 / 2) n_test = 50 x_test = np.linspace(-2.5, 2.5, n_test) #n_test = 128 #x_test = np.linspace(-np.pi, np.pi, n_test, endpoint=False) u0_test = np.exp(-x_test**2 / 2) * np.exp(1j * lam * k0 * x_test) bridge_kw = dict(lam=lam, n_guesses=50, xi_range=(-10.0, 10.0), verbose=verbose) def _run(label, bridge, ref_vals, tol_factor=3.0): vals = bridge.evaluate_grid(x_test, u0_phase_sym, u0_amp_sym) err = np.abs(vals - ref_vals) / (np.abs(ref_vals) + 1e-12) maxe = float(np.max(err)) ok = maxe < tol_factor / lam print(f" Max relative error : {maxe:.5f} => {'PASS' if ok else 'FAIL'}") return dict(passed=ok, max_rel_error=maxe, values_bridge=vals, values_ref=ref_vals, x_test=x_test) # ── TEST 1 : P = ξ² ───────────────────────────────────────────────────── print("\n" + "="*60) print("TEST 1 — Elliptic psiOp : P = ξ²") print(f" WKB reference : {k0**2:.2f} · u0(x)") print("="*60) P1 = PseudoDifferentialOperator(xi_sym**2, vars_x=[x_sym], mode='symbol') results['test1'] = _run('P=ξ²', PsiOpFIOBridge(P1, **bridge_kw), k0**2 * u0_test) results['test1']['label'] = 'P=ξ²' # ── TEST 2 : P = c·ξ ──────────────────────────────────────────────────── print("\n" + "="*60) c = 2.0 print(f"TEST 2 — Transport psiOp : P = {c}·ξ") print(f" WKB reference : {c*k0:.2f} · u0(x)") print("="*60) P2 = PseudoDifferentialOperator(c * xi_sym, vars_x=[x_sym], mode='symbol') results['test2'] = _run('P=2ξ', PsiOpFIOBridge(P2, **bridge_kw), c * k0 * u0_test) results['test2']['label'] = 'P=2·ξ' # ── TEST 3 : P∘Q = ξ³ ─────────────────────────────────────────────────── print("\n" + "="*60) print("TEST 3 — Composition P∘Q : P=ξ², Q=ξ ⟹ PQ=ξ³") print(f" WKB reference : {k0**3:.2f} · u0(x)") print("="*60) Q3 = PseudoDifferentialOperator(xi_sym, vars_x=[x_sym], mode='symbol') cb3 = CompositionBridge(P1, Q3, comp_order=1, **bridge_kw) results['test3'] = _run('PQ=ξ³', cb3, k0**3 * u0_test, tol_factor=5.0) results['test3']['label'] = 'P∘Q = ξ³' # ── TEST 4 : Asymptotic right-inverse ──────────────────────────────────── print("\n" + "="*60) print("TEST 4 — Asymptotic right-inverse : P = ξ²+1") print("="*60) P4 = PseudoDifferentialOperator(xi_sym**2 + 1, vars_x=[x_sym], mode='symbol') R_sym = P4.right_inverse_asymptotic(order=1) R4 = PseudoDifferentialOperator(R_sym, vars_x=[x_sym], mode='symbol') # (a) symbolic check: P∘R ≈ Id PR_sym = P4.compose_asymptotic(R4, order=1) PR_diff = sp.simplify(PR_sym - 1) xi_pts = np.linspace(1.0, 8.0, 30) pr_func = sp.lambdify((x_sym, xi_sym), PR_diff, 'numpy') resid_sym = float(np.max(np.abs(pr_func(np.zeros_like(xi_pts), xi_pts)))) print(f" (a) Symbolic residual ‖P∘R − Id‖∞ = {resid_sym:.2e}") # (b) numeric check bridge4 = PsiOpFIOBridge(R4, **bridge_kw) p4_at_k0 = k0**2 + 1 res4 = _run('R=(ξ²+1)⁻¹', bridge4, u0_test / p4_at_k0) res4['residual_sym'] = resid_sym res4['passed'] = res4['passed'] and (resid_sym < 1e-10) print(f" (b) Numeric error = {res4['max_rel_error']:.5f} => " f"{'PASS' if res4['passed'] else 'FAIL'}") results['test4'] = res4 results['test4']['label'] = 'R=(ξ²+1)⁻¹' # ── TEST 5 : Propagator exp(it·ξ) ──────────────────────────────────────── print("\n" + "="*60) t5 = 1.0 print(f"TEST 5 — Propagator exp(it·ξ), t={t5}") print(f" WKB reference : exp(i·{k0}·{t5}) · u0(x)") print("="*60) exp_sym5 = sp.exp(sp.I * t5 * xi_sym) expP5 = PseudoDifferentialOperator(exp_sym5, vars_x=[x_sym], mode='symbol') results['test5'] = _run('exp(it·ξ)', PsiOpFIOBridge(expP5, **bridge_kw), np.exp(1j * t5 * k0) * u0_test) results['test5']['label'] = 'exp(it·ξ)' # ── TEST 6 : WKBState ──────────────────────────────────────────────────── print("\n" + "="*60) print("TEST 6 — WKBState : to_array and as_callable") print(" u0(x) = exp(-x²/2) · exp(iλk₀x)") print("="*60) wkb = WKBState( amp_sym = u0_amp_sym, phase_sym = u0_phase_sym, var_x = y_sym, lam = lam, ) # to_array must reproduce the reference WKB array u_wkb_arr = wkb.to_array(x_test) err6 = float(np.max(np.abs(u_wkb_arr - u0_test) / (np.abs(u0_test) + 1e-12))) ok6 = err6 < 1e-10 # as_callable must return the same values when called as f(x) ic_fn = wkb.as_callable() u_from_ic = ic_fn(x_test) err6b = float(np.max(np.abs(u_from_ic - u0_test) / (np.abs(u0_test) + 1e-12))) ok6 = ok6 and (err6b < 1e-10) # dominant wavenumber should be close to lam * k0 k_dom = wkb.dominant_wavenumber(x_test) ok6 = ok6 and (abs(k_dom - lam * k0) / (lam * k0) < 0.05) print(f" to_array error : {err6:.2e}") print(f" callable error : {err6b:.2e}") print(f" dominant k = {k_dom:.2f} (expected {lam*k0:.2f})") print(f" => {'PASS' if ok6 else 'FAIL'}") results['test6'] = dict( passed = ok6, max_rel_error = max(err6, err6b), label = 'WKBState', x_test = x_test, values_bridge = u_wkb_arr, values_ref = u0_test, ) # ── TEST 7 : SpectralSplitter ───────────────────────────────────────── print("\n" + "="*60) print("TEST 7 — SpectralSplitter : lossless split and energy ratio") print("="*60) # Use the WKB state: most energy should be at k ≈ ±lam*k0 (high freq) splitter = SpectralSplitter(x_test, k_cut=lam * k0 / 2) u_low, u_high = splitter.split(u0_test) # Lossless: merge should recover the original u_merged = splitter.merge(u_low, u_high) err7_merge = float(np.max(np.abs(u_merged - u0_test) / (np.abs(u0_test) + 1e-12))) # Energy: WKB state is almost entirely high-frequency e_low, e_high = splitter.energy_ratio(u0_test) ok7 = (err7_merge < 1e-10) and (e_high > 0.8) print(f" Merge error : {err7_merge:.2e} (must be < 1e-10)") print(f" E_low / E_tot : {e_low:.3f}") print(f" E_high / E_tot : {e_high:.3f} (WKB state: expect > 0.8)") print(f" => {'PASS' if ok7 else 'FAIL'}") results['test7'] = dict( passed = ok7, max_rel_error = err7_merge, label = 'SpectralSplitter', x_test = x_test, values_bridge = u_merged, values_ref = u0_test, ) # ── TEST 8 : SemiclassicalCorrector ─────────────────────────────────── print("\n" + "="*60) print("TEST 8 — SemiclassicalCorrector : correction magnitude") print(" P = ξ², u0 = WKB state") print("="*60) # Reference: (Pu0)(x) = k0² u0(x) ref_pu0 = k0**2 * u0_test # Intentionally corrupt the high-frequency part of ref_pu0 splitter8 = SpectralSplitter(x_test, k_cut=lam * k0 / 2) u_low8, _ = splitter8.split(ref_pu0) noise = 0.3 * np.random.default_rng(42).standard_normal(len(x_test)) u_corrupted = splitter8.merge(u_low8, noise) # wrong high-freq part corrector = SemiclassicalCorrector( op = P1, # ξ² from test 1 splitter = splitter8, **bridge_kw, ) wkb8 = WKBState(u0_amp_sym, u0_phase_sym, y_sym, lam=lam) u_corrected = corrector.correct(u_corrupted, wkb8) # After correction, high-freq part should be close to bridge result err8 = float(np.max( np.abs(u_corrected - ref_pu0) / (np.abs(ref_pu0) + 1e-12) )) # Correction must have changed the solution significantly mag8 = corrector.correction_magnitude(u_corrupted, wkb8) ok8 = (err8 < 5.0 / lam) and (mag8 > 0.05) print(f" Error after correction : {err8:.2e} (must be < {5/lam:.2e} = 5/lam)") print(f" Correction magnitude : {mag8:.3f} (must be > 0.05)") print(f" => {'PASS' if ok8 else 'FAIL'}") results['test8'] = dict( passed = ok8, max_rel_error = err8, label = 'SemiclassicalCorrector', x_test = x_test, values_bridge = u_corrected, values_ref = ref_pu0, ) # ── TEST 9 : CrossValidator (bridge-only path) ──────────────────────── print("\n" + "="*60) print("TEST 9 — CrossValidator : bridge path + ValidationReport") print(" P = ξ², comparing bridge vs WKB reference") print("="*60) wkb9 = WKBState(u0_amp_sym, u0_phase_sym, y_sym, lam=lam) cv9 = CrossValidator( op = P1, wkb_state = wkb9, x_grid = x_test, lam = lam, bridge_kwargs = dict(n_guesses=50, xi_range=(-10., 10.)), ) # Run bridge only (no solver.py required) u_bridge9 = cv9.run_bridge_only() # Build a manual report using the WKB reference as "solver" report9 = cv9._build_report(ref_pu0, u_bridge9) ok9 = ( isinstance(report9, ValidationReport) and report9.max_rel_error < 3.0 / lam and report9.wkb_valid and report9.error_spectrum.shape == (len(x_test),) and report9.k_grid.shape == (len(x_test),) ) print(f" Max rel error : {report9.max_rel_error:.2e} (must be < {3/lam:.2e})") print(f" WKB valid : {report9.wkb_valid}") print(f" error_spectrum : shape {report9.error_spectrum.shape} ✓") print(f" => {'PASS' if ok9 else 'FAIL'}") results['test9'] = dict( passed = ok9, max_rel_error = report9.max_rel_error, label = 'CrossValidator (bridge path)', x_test = x_test, values_bridge = u_bridge9, values_ref = ref_pu0, ) # ── Summary ────────────────────────────────────────────────────────────── print("\n" + "="*60 + "\nSUMMARY\n" + "="*60) n_pass = 0 for k, v in results.items(): ok = v.get('passed', False) n_pass += int(ok) print(f" {k} : {'PASS' if ok else 'FAIL'} " f"(max_rel_err={v.get('max_rel_error', 0.0):.2e}) {v['label']}") print(f"\n Total : {n_pass}/{len(results)} tests passed") # ── Plot ───────────────────────────────────────────────────────────────── if plot: fig, axes = plt.subplots(2, 3, figsize=(15, 8)) fig.suptitle( "fio_bridge — asymptotic bridge (red dashed) vs WKB reference (black)\n" "u0(y)=exp(−y²/2)·exp(iλk0y), k0=2, λ=40 | ref: (Pu)(x)=p(k0)·u0(x)", fontsize=10, ) plot_order = ['test1', 'test2', 'test3', 'test4', 'test5'] flat_axes = [axes[0,0], axes[0,1], axes[0,2], axes[1,0], axes[1,1]] for key, ax in zip(plot_order, flat_axes): r = results[key] xt = r['x_test'] vb = r['values_bridge'] vr = r['values_ref'] ax.plot(xt, np.real(vr), 'k-', lw=2, label='WKB ref (Re)') ax.plot(xt, np.real(vb), 'r--', lw=1.5, label='Bridge (Re)') ax.plot(xt, np.imag(vr), 'b-', lw=1, alpha=0.6, label='WKB ref (Im)') ax.plot(xt, np.imag(vb), 'm--', lw=1, alpha=0.6, label='Bridge (Im)') ok = r['passed'] err = r.get('max_rel_error', 0.0) ax.set_title(f"[{'PASS' if ok else 'FAIL'}] {r['label']}\nerr={err:.2e}", fontsize=9) ax.legend(fontsize=7, loc='best') ax.set_xlabel('x', fontsize=8) ax.grid(True, alpha=0.3) ax6 = axes[1, 2] ax6.axis('off') lines = ["Semi-classical WKB reference:", " (Pu)(x) = p(k0) · u0(x)", "", "Tests:"] for k, v in results.items(): lines.append(f" {k} {'PASS' if v['passed'] else 'FAIL'} " f"err={v.get('max_rel_error',0.0):.2e} {v['label']}") lines += ["", f"Total: {sum(v['passed'] for v in results.values())}/{len(results)}"] ax6.text(0.05, 0.95, "\n".join(lines), va='top', ha='left', transform=ax6.transAxes, fontsize=9, family='monospace', bbox=dict(boxstyle='round', facecolor='lightyellow', alpha=0.9)) plt.tight_layout() plt.show() return results
# ───────────────────────────────────────────────────────────────────────────── # Entry point # ───────────────────────────────────────────────────────────────────────────── if __name__ == '__main__': run_test_suite(verbose=True, plot=True)