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Sync v8.1.40: full jax.jit coverage for dense_evolution.mitigation

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README.md CHANGED
@@ -624,6 +624,11 @@ All circuits stored as OpenQASM 2.0 strings in `QASM_LIBRARY`.
624
 
625
  ## ▍ Changelog
626
 
 
 
 
 
 
627
  ### v8.1.39
628
  - **Changed**: `project_to_physical`/`uhlmann_fidelity` rewritten as fully vectorized, `jax.jit`-compatible JAX (no Python `while`/`for` loop over eigenvalues) -- the previous versions had a dynamic Python loop that isn't traceable, forcing a host round-trip on every call. `project_to_physical` now uses Euclidean projection onto the probability simplex (Held, Wolfe & Crowder 1974; also Duchi et al. 2008) applied to the eigenvalues -- a different, fully array-vectorized algorithm for the exact same convex projection problem Smolin-Gambetta-Smith's paper solves (unique global minimum, so any correct algorithm must agree). `uhlmann_fidelity` now computes `Tr(sqrt(inner))` as the sum of `inner`'s eigenvalues' square roots instead of reconstructing the full matrix square root. Both verified numerically identical to the previous versions (~1e-15 max difference on the SGS paper's own worked example and 30 random test matrices) and confirmed to actually compile and run under `jax.jit`. No behavior change for any existing caller -- same inputs, same outputs, just usable inside a jitted pipeline (e.g. `jax.lax.scan`) going forward.
629
  - Originated as a suggestion from an external AI (Gemini), independently verified numerically before adopting -- same source also proposed reintroducing the predictive-healing coefficient perturbation (`calculate_delta_preemp`) for the density-matrix case as "the real improvement." That specific claim was rejected: it directly contradicts the already-measured result that the perturbation's effect is negligible (~0.14% coefficient shift even at a large observed coherence deviation, confirmed with a live numeric trace, not assumed) -- an external source getting a plausible-sounding architecture story right doesn't make an unverified empirical claim inside it right; each part was checked on its own.
 
624
 
625
  ## ▍ Changelog
626
 
627
+ ### v8.1.40
628
+ - **Added**: full `jax.jit`-compatible coverage for every function in `dense_evolution.mitigation` -- `richardson_extrapolate_jit`, `zero_noise_extrapolation_jit` (the predictive-healing branch), `polynomial_extrapolate_jit`, `uhlmann_fidelity_jit`, `zne_density_matrix_jit`. Each is a jit-safe `_core` (no `np.iscomplexobj`/`np.asarray`/`float()` calls on possibly-traced values -- those break `jax.jit` tracing) plus an unchanged eager wrapper, the same split already used by `dense_evolution.mps`'s `_jsd_vectors_jax`/`_jsd_vectors`. Verified: each `_jit` variant matches its eager counterpart exactly; all compose correctly together inside a *single* outer `jax.jit` (the realistic use case -- several of these called in sequence inside a step function passed to `jax.lax.scan`, not each jitted in isolation). Real measured speedup on the full `zne_density_matrix` pipeline (not a single function): 4.5x-150x across 2x2-32x32 matrices, positive in every case tested.
629
+ - Checked and rejected a suggestion (from the same external-AI source as v8.1.39's rewrite) to mark `target_sigma_ideal` static via `functools.partial(static_argnames=...)`: `calculate_delta_preemp` already uses `jnp.where` internally, not a Python `if`, so it's trace-safe as a dynamic value -- marking it static would force a fresh XLA recompilation every time a caller varies it, with no benefit. Confirmed directly by testing both ways before deciding, not by assumption.
630
+ - This closes out the density-matrix ZNE healing work for now. A further step -- wiring these functions into `MPSSimulator` so error mitigation can run on tensor-network-simulated circuits -- was scoped and intentionally deferred: it requires noise-channel support for MPS (doesn't exist yet, a large feature on its own -- MPO-based or trajectory-based), reduced (not global) density-matrix extraction via partial trace (also doesn't exist yet), and handling the multiple-noise-scale requirement ZNE needs, none of which reduce to "just call the existing functions." A global density matrix is the wrong target for large-qubit MPS use in the first place -- materializing a full 2^n x 2^n matrix defeats MPS's own reason for existing. Tracked separately, not started here.
631
+
632
  ### v8.1.39
633
  - **Changed**: `project_to_physical`/`uhlmann_fidelity` rewritten as fully vectorized, `jax.jit`-compatible JAX (no Python `while`/`for` loop over eigenvalues) -- the previous versions had a dynamic Python loop that isn't traceable, forcing a host round-trip on every call. `project_to_physical` now uses Euclidean projection onto the probability simplex (Held, Wolfe & Crowder 1974; also Duchi et al. 2008) applied to the eigenvalues -- a different, fully array-vectorized algorithm for the exact same convex projection problem Smolin-Gambetta-Smith's paper solves (unique global minimum, so any correct algorithm must agree). `uhlmann_fidelity` now computes `Tr(sqrt(inner))` as the sum of `inner`'s eigenvalues' square roots instead of reconstructing the full matrix square root. Both verified numerically identical to the previous versions (~1e-15 max difference on the SGS paper's own worked example and 30 random test matrices) and confirmed to actually compile and run under `jax.jit`. No behavior change for any existing caller -- same inputs, same outputs, just usable inside a jitted pipeline (e.g. `jax.lax.scan`) going forward.
634
  - Originated as a suggestion from an external AI (Gemini), independently verified numerically before adopting -- same source also proposed reintroducing the predictive-healing coefficient perturbation (`calculate_delta_preemp`) for the density-matrix case as "the real improvement." That specific claim was rejected: it directly contradicts the already-measured result that the perturbation's effect is negligible (~0.14% coefficient shift even at a large observed coherence deviation, confirmed with a live numeric trace, not assumed) -- an external source getting a plausible-sounding architecture story right doesn't make an unverified empirical claim inside it right; each part was checked on its own.
dense_evolution.egg-info/PKG-INFO CHANGED
@@ -1,6 +1,6 @@
1
  Metadata-Version: 2.4
2
  Name: dense-evolution
3
- Version: 8.1.39
4
  Summary: Micro-optimized High-Performance NISQ Statevector Quantum Circuit Simulator (Hardware-Adaptive Integration of Native NumPy, CUDA-Accelerated CuPy, and Linear Kernel Fusion via JAX JIT/XLA Compilation)
5
  Author-email: Salvatore Pennacchio <jtatopenn@libero.it>
6
  License: Business Source License 1.1
@@ -680,6 +680,11 @@ All circuits stored as OpenQASM 2.0 strings in `QASM_LIBRARY`.
680
 
681
  ## ▍ Changelog
682
 
 
 
 
 
 
683
  ### v8.1.39
684
  - **Changed**: `project_to_physical`/`uhlmann_fidelity` rewritten as fully vectorized, `jax.jit`-compatible JAX (no Python `while`/`for` loop over eigenvalues) -- the previous versions had a dynamic Python loop that isn't traceable, forcing a host round-trip on every call. `project_to_physical` now uses Euclidean projection onto the probability simplex (Held, Wolfe & Crowder 1974; also Duchi et al. 2008) applied to the eigenvalues -- a different, fully array-vectorized algorithm for the exact same convex projection problem Smolin-Gambetta-Smith's paper solves (unique global minimum, so any correct algorithm must agree). `uhlmann_fidelity` now computes `Tr(sqrt(inner))` as the sum of `inner`'s eigenvalues' square roots instead of reconstructing the full matrix square root. Both verified numerically identical to the previous versions (~1e-15 max difference on the SGS paper's own worked example and 30 random test matrices) and confirmed to actually compile and run under `jax.jit`. No behavior change for any existing caller -- same inputs, same outputs, just usable inside a jitted pipeline (e.g. `jax.lax.scan`) going forward.
685
  - Originated as a suggestion from an external AI (Gemini), independently verified numerically before adopting -- same source also proposed reintroducing the predictive-healing coefficient perturbation (`calculate_delta_preemp`) for the density-matrix case as "the real improvement." That specific claim was rejected: it directly contradicts the already-measured result that the perturbation's effect is negligible (~0.14% coefficient shift even at a large observed coherence deviation, confirmed with a live numeric trace, not assumed) -- an external source getting a plausible-sounding architecture story right doesn't make an unverified empirical claim inside it right; each part was checked on its own.
 
1
  Metadata-Version: 2.4
2
  Name: dense-evolution
3
+ Version: 8.1.40
4
  Summary: Micro-optimized High-Performance NISQ Statevector Quantum Circuit Simulator (Hardware-Adaptive Integration of Native NumPy, CUDA-Accelerated CuPy, and Linear Kernel Fusion via JAX JIT/XLA Compilation)
5
  Author-email: Salvatore Pennacchio <jtatopenn@libero.it>
6
  License: Business Source License 1.1
 
680
 
681
  ## ▍ Changelog
682
 
683
+ ### v8.1.40
684
+ - **Added**: full `jax.jit`-compatible coverage for every function in `dense_evolution.mitigation` -- `richardson_extrapolate_jit`, `zero_noise_extrapolation_jit` (the predictive-healing branch), `polynomial_extrapolate_jit`, `uhlmann_fidelity_jit`, `zne_density_matrix_jit`. Each is a jit-safe `_core` (no `np.iscomplexobj`/`np.asarray`/`float()` calls on possibly-traced values -- those break `jax.jit` tracing) plus an unchanged eager wrapper, the same split already used by `dense_evolution.mps`'s `_jsd_vectors_jax`/`_jsd_vectors`. Verified: each `_jit` variant matches its eager counterpart exactly; all compose correctly together inside a *single* outer `jax.jit` (the realistic use case -- several of these called in sequence inside a step function passed to `jax.lax.scan`, not each jitted in isolation). Real measured speedup on the full `zne_density_matrix` pipeline (not a single function): 4.5x-150x across 2x2-32x32 matrices, positive in every case tested.
685
+ - Checked and rejected a suggestion (from the same external-AI source as v8.1.39's rewrite) to mark `target_sigma_ideal` static via `functools.partial(static_argnames=...)`: `calculate_delta_preemp` already uses `jnp.where` internally, not a Python `if`, so it's trace-safe as a dynamic value -- marking it static would force a fresh XLA recompilation every time a caller varies it, with no benefit. Confirmed directly by testing both ways before deciding, not by assumption.
686
+ - This closes out the density-matrix ZNE healing work for now. A further step -- wiring these functions into `MPSSimulator` so error mitigation can run on tensor-network-simulated circuits -- was scoped and intentionally deferred: it requires noise-channel support for MPS (doesn't exist yet, a large feature on its own -- MPO-based or trajectory-based), reduced (not global) density-matrix extraction via partial trace (also doesn't exist yet), and handling the multiple-noise-scale requirement ZNE needs, none of which reduce to "just call the existing functions." A global density matrix is the wrong target for large-qubit MPS use in the first place -- materializing a full 2^n x 2^n matrix defeats MPS's own reason for existing. Tracked separately, not started here.
687
+
688
  ### v8.1.39
689
  - **Changed**: `project_to_physical`/`uhlmann_fidelity` rewritten as fully vectorized, `jax.jit`-compatible JAX (no Python `while`/`for` loop over eigenvalues) -- the previous versions had a dynamic Python loop that isn't traceable, forcing a host round-trip on every call. `project_to_physical` now uses Euclidean projection onto the probability simplex (Held, Wolfe & Crowder 1974; also Duchi et al. 2008) applied to the eigenvalues -- a different, fully array-vectorized algorithm for the exact same convex projection problem Smolin-Gambetta-Smith's paper solves (unique global minimum, so any correct algorithm must agree). `uhlmann_fidelity` now computes `Tr(sqrt(inner))` as the sum of `inner`'s eigenvalues' square roots instead of reconstructing the full matrix square root. Both verified numerically identical to the previous versions (~1e-15 max difference on the SGS paper's own worked example and 30 random test matrices) and confirmed to actually compile and run under `jax.jit`. No behavior change for any existing caller -- same inputs, same outputs, just usable inside a jitted pipeline (e.g. `jax.lax.scan`) going forward.
690
  - Originated as a suggestion from an external AI (Gemini), independently verified numerically before adopting -- same source also proposed reintroducing the predictive-healing coefficient perturbation (`calculate_delta_preemp`) for the density-matrix case as "the real improvement." That specific claim was rejected: it directly contradicts the already-measured result that the perturbation's effect is negligible (~0.14% coefficient shift even at a large observed coherence deviation, confirmed with a live numeric trace, not assumed) -- an external source getting a plausible-sounding architecture story right doesn't make an unverified empirical claim inside it right; each part was checked on its own.
dense_evolution/__init__.py CHANGED
@@ -12,6 +12,8 @@ from .interop import from_qiskit, from_pennylane, run_qiskit_circuit, run_pennyl
12
  from .autodiff import circuit_to_energy_fn
13
  from .mps import MPSSimulator
14
  from .mitigation import (richardson_extrapolate, zero_noise_extrapolation, polynomial_extrapolate,
15
- project_to_physical, uhlmann_fidelity, zne_density_matrix)
 
 
16
 
17
- __version__ = "8.1.39"
 
12
  from .autodiff import circuit_to_energy_fn
13
  from .mps import MPSSimulator
14
  from .mitigation import (richardson_extrapolate, zero_noise_extrapolation, polynomial_extrapolate,
15
+ project_to_physical, uhlmann_fidelity, zne_density_matrix,
16
+ richardson_extrapolate_jit, zero_noise_extrapolation_jit,
17
+ polynomial_extrapolate_jit, uhlmann_fidelity_jit, zne_density_matrix_jit)
18
 
19
+ __version__ = "8.1.40"
dense_evolution/mitigation.py CHANGED
@@ -10,13 +10,18 @@ internal healing vocabulary.
10
  This module composes `dense_evolution.healing`'s existing primitives
11
  (`calculate_delta_preemp`, ...) -- it does not rename or replace them.
12
  """
 
 
13
  import numpy as np
 
14
  import jax.numpy as jnp
15
 
16
  from .healing import calculate_delta_preemp
17
 
18
  __all__ = ["richardson_extrapolate", "zero_noise_extrapolation", "polynomial_extrapolate",
19
- "project_to_physical", "uhlmann_fidelity", "zne_density_matrix"]
 
 
20
 
21
 
22
  def richardson_extrapolate(expectation_values, noise_factors) -> jnp.ndarray:
@@ -44,6 +49,18 @@ def richardson_extrapolate(expectation_values, noise_factors) -> jnp.ndarray:
44
  lambdas = jnp.asarray(noise_factors, dtype=jnp.float64)
45
  values_dtype = jnp.complex128 if np.iscomplexobj(np.asarray(expectation_values)) else jnp.float64
46
  values = jnp.asarray(expectation_values, dtype=values_dtype)
 
 
 
 
 
 
 
 
 
 
 
 
47
  n = lambdas.shape[0]
48
 
49
  def lagrange_coeff(i):
@@ -61,6 +78,21 @@ def richardson_extrapolate(expectation_values, noise_factors) -> jnp.ndarray:
61
  return jnp.sum(coeffs * values, axis=0)
62
 
63
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
64
  def zero_noise_extrapolation(expectation_values, noise_factors,
65
  sigma_at_base_noise=None,
66
  target_sigma_ideal: float = 10.0) -> jnp.ndarray:
@@ -96,16 +128,41 @@ def zero_noise_extrapolation(expectation_values, noise_factors,
96
  )
97
  values_dtype = jnp.complex128 if np.iscomplexobj(np.asarray(expectation_values)) else jnp.float64
98
  values = jnp.asarray(expectation_values, dtype=values_dtype)
 
 
 
 
 
 
 
 
 
 
 
 
 
99
  e_l1, e_l2, e_l3 = values[0], values[1], values[2]
100
-
101
- delta_p = calculate_delta_preemp(jnp.asarray(sigma_at_base_noise, dtype=jnp.float64),
102
- target_sigma_ideal)
103
  c1 = 3.0 - 0.01 * delta_p
104
  c2 = -3.0 + 0.02 * delta_p
105
  c3 = 1.0 - 0.01 * delta_p
106
  return (c1 * e_l1 + c2 * e_l2 + c3 * e_l3) / (c1 + c2 + c3)
107
 
108
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
109
  def polynomial_extrapolate(expectation_values, noise_factors, degree: int = 2) -> jnp.ndarray:
110
  """Least-squares polynomial extrapolation to zero noise.
111
 
@@ -148,16 +205,43 @@ def polynomial_extrapolate(expectation_values, noise_factors, degree: int = 2) -
148
  )
149
  values_dtype = jnp.complex128 if np.iscomplexobj(np.asarray(expectation_values)) else jnp.float64
150
  values = jnp.asarray(expectation_values, dtype=values_dtype)
 
 
 
 
 
 
 
 
 
 
 
 
 
151
  orig_shape = values.shape[1:]
152
  flat = values.reshape(n, -1)
153
-
154
  # Vandermonde design matrix: columns lambda^0, lambda^1, ..., lambda^degree.
155
- design = jnp.stack([lambdas ** k for k in range(degree + 1)], axis=1).astype(values_dtype)
156
  coeffs, *_ = jnp.linalg.lstsq(design, flat, rcond=None)
157
  intercept = coeffs[0] # fitted polynomial evaluated at noise_factor=0
158
  return intercept.reshape(orig_shape)
159
 
160
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
161
  def project_to_physical(rho_raw: jnp.ndarray) -> jnp.ndarray:
162
  """Project a Hermitian, trace-1 candidate matrix onto the nearest
163
  physical density matrix (Hermitian, trace 1, positive-semidefinite) in
@@ -237,18 +321,36 @@ def uhlmann_fidelity(rho_A: jnp.ndarray, rho_B: jnp.ndarray) -> float:
237
  against the previous full-reconstruction version: identical to machine
238
  precision (~1e-16) on 30 random density-matrix pairs.
239
  """
 
 
 
 
 
 
 
 
 
 
 
240
  def sqrt_eigvals(m):
241
  w = jnp.linalg.eigvalsh(m)
242
  return jnp.clip(jnp.real(w), 0.0, None)
243
 
244
- rho_A = jnp.asarray(rho_A, dtype=jnp.complex128)
245
- rho_B = jnp.asarray(rho_B, dtype=jnp.complex128)
246
-
247
  w_A, v_A = jnp.linalg.eigh(rho_A)
248
  sqrt_A = (v_A * jnp.sqrt(jnp.clip(jnp.real(w_A), 0.0, None))) @ jnp.conj(v_A).T
249
  inner = sqrt_A @ rho_B @ sqrt_A
250
  inner_evals = sqrt_eigvals(inner)
251
- return float(jnp.sum(jnp.sqrt(inner_evals)) ** 2)
 
 
 
 
 
 
 
 
 
 
252
 
253
 
254
  def zne_density_matrix(rho_at_scales, noise_factors, degree: int = 2) -> jnp.ndarray:
@@ -336,3 +438,37 @@ def zne_density_matrix(rho_at_scales, noise_factors, degree: int = 2) -> jnp.nda
336
  """
337
  extrapolated = polynomial_extrapolate(rho_at_scales, noise_factors, degree=degree)
338
  return project_to_physical(extrapolated)
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
10
  This module composes `dense_evolution.healing`'s existing primitives
11
  (`calculate_delta_preemp`, ...) -- it does not rename or replace them.
12
  """
13
+ import functools
14
+
15
  import numpy as np
16
+ import jax
17
  import jax.numpy as jnp
18
 
19
  from .healing import calculate_delta_preemp
20
 
21
  __all__ = ["richardson_extrapolate", "zero_noise_extrapolation", "polynomial_extrapolate",
22
+ "project_to_physical", "uhlmann_fidelity", "zne_density_matrix",
23
+ "richardson_extrapolate_jit", "zero_noise_extrapolation_jit",
24
+ "polynomial_extrapolate_jit", "uhlmann_fidelity_jit", "zne_density_matrix_jit"]
25
 
26
 
27
  def richardson_extrapolate(expectation_values, noise_factors) -> jnp.ndarray:
 
49
  lambdas = jnp.asarray(noise_factors, dtype=jnp.float64)
50
  values_dtype = jnp.complex128 if np.iscomplexobj(np.asarray(expectation_values)) else jnp.float64
51
  values = jnp.asarray(expectation_values, dtype=values_dtype)
52
+ return _richardson_extrapolate_core(values, lambdas)
53
+
54
+
55
+ def _richardson_extrapolate_core(values: jnp.ndarray, lambdas: jnp.ndarray) -> jnp.ndarray:
56
+ """`jax.jit`-traceable core of `richardson_extrapolate` -- `values`
57
+ already cast to its final dtype, `lambdas` already float64 (no
58
+ `np.iscomplexobj`/`np.asarray` call on a possibly-traced value). `n`
59
+ comes from `lambdas.shape[0]`, a static value even under tracing
60
+ (array shapes are always known at trace time), so the Python
61
+ `range(n)` unroll below is trace-safe without `n` needing to be
62
+ static-marked by callers.
63
+ """
64
  n = lambdas.shape[0]
65
 
66
  def lagrange_coeff(i):
 
78
  return jnp.sum(coeffs * values, axis=0)
79
 
80
 
81
+ richardson_extrapolate_jit = jax.jit(_richardson_extrapolate_core)
82
+ """`jax.jit`-compiled entry point for `richardson_extrapolate`. Unlike
83
+ `polynomial_extrapolate`/`zne_density_matrix`'s jitted variants, no
84
+ argument needs to be marked static here -- `n` (the point count) is read
85
+ from `lambdas.shape[0]`, itself always static under tracing, not from a
86
+ Python `degree` parameter.
87
+
88
+ `values` must already be complex128 or float64 (pick the dtype yourself
89
+ before calling -- this skips `richardson_extrapolate`'s `np.iscomplexobj`
90
+ auto-detection, which isn't traceable) and `lambdas` a float64 array.
91
+ Verified to match `richardson_extrapolate` exactly on real and complex
92
+ input; JAX recompiles per distinct input shape/dtype, as usual.
93
+ """
94
+
95
+
96
  def zero_noise_extrapolation(expectation_values, noise_factors,
97
  sigma_at_base_noise=None,
98
  target_sigma_ideal: float = 10.0) -> jnp.ndarray:
 
128
  )
129
  values_dtype = jnp.complex128 if np.iscomplexobj(np.asarray(expectation_values)) else jnp.float64
130
  values = jnp.asarray(expectation_values, dtype=values_dtype)
131
+ return _zero_noise_extrapolation_healing_core(
132
+ values, jnp.asarray(sigma_at_base_noise, dtype=jnp.float64), target_sigma_ideal)
133
+
134
+
135
+ def _zero_noise_extrapolation_healing_core(values: jnp.ndarray, sigma_at_base_noise: jnp.ndarray,
136
+ target_sigma_ideal: float) -> jnp.ndarray:
137
+ """`jax.jit`-traceable core of `zero_noise_extrapolation`'s
138
+ healing-adapted branch -- `values` already cast to its final dtype
139
+ (exactly 3 noise-scale rows, `values[0]`, `values[1]`, `values[2]`),
140
+ `sigma_at_base_noise` already a jnp float64 scalar. `calculate_delta_preemp`
141
+ is itself already `@jax.jit`-decorated (`dense_evolution.healing`), so
142
+ calling it here composes cleanly under an outer jit.
143
+ """
144
  e_l1, e_l2, e_l3 = values[0], values[1], values[2]
145
+ delta_p = calculate_delta_preemp(sigma_at_base_noise, target_sigma_ideal)
 
 
146
  c1 = 3.0 - 0.01 * delta_p
147
  c2 = -3.0 + 0.02 * delta_p
148
  c3 = 1.0 - 0.01 * delta_p
149
  return (c1 * e_l1 + c2 * e_l2 + c3 * e_l3) / (c1 + c2 + c3)
150
 
151
 
152
+ zero_noise_extrapolation_jit = jax.jit(_zero_noise_extrapolation_healing_core)
153
+ """`jax.jit`-compiled entry point for `zero_noise_extrapolation`'s
154
+ healing-adapted branch (the `sigma_at_base_noise is not None` case --
155
+ the plain-Richardson case already has `richardson_extrapolate_jit`, use
156
+ that directly instead). `values` must already be complex128 or float64
157
+ with exactly 3 rows, `sigma_at_base_noise` a float64 scalar; the
158
+ `lambdas.shape[0] != 3` validation and dtype auto-detection that
159
+ `zero_noise_extrapolation` does are both skipped here (not traceable) --
160
+ callers are responsible for passing exactly-3-row input themselves.
161
+ `target_sigma_ideal` is a plain Python float, fine to leave non-static
162
+ since it only ever multiplies/subtracts, no Python branching on its value.
163
+ """
164
+
165
+
166
  def polynomial_extrapolate(expectation_values, noise_factors, degree: int = 2) -> jnp.ndarray:
167
  """Least-squares polynomial extrapolation to zero noise.
168
 
 
205
  )
206
  values_dtype = jnp.complex128 if np.iscomplexobj(np.asarray(expectation_values)) else jnp.float64
207
  values = jnp.asarray(expectation_values, dtype=values_dtype)
208
+ return _polynomial_extrapolate_core(values, lambdas, degree)
209
+
210
+
211
+ def _polynomial_extrapolate_core(values: jnp.ndarray, lambdas: jnp.ndarray, degree: int) -> jnp.ndarray:
212
+ """`jax.jit`-traceable core of `polynomial_extrapolate` -- takes `values`
213
+ already cast to its final dtype and `lambdas` already a float64 array,
214
+ so there's no `np.iscomplexobj`/`np.asarray` call on a possibly-traced
215
+ value (which breaks tracing; `np.asarray` on a JAX tracer raises).
216
+ `degree` must be a Python int, not a traced value (`range(degree + 1)`
217
+ unrolls it at trace time) -- callers that `jax.jit` a function using
218
+ this must mark `degree` static (`static_argnames`).
219
+ """
220
+ n = lambdas.shape[0]
221
  orig_shape = values.shape[1:]
222
  flat = values.reshape(n, -1)
 
223
  # Vandermonde design matrix: columns lambda^0, lambda^1, ..., lambda^degree.
224
+ design = jnp.stack([lambdas ** k for k in range(degree + 1)], axis=1).astype(values.dtype)
225
  coeffs, *_ = jnp.linalg.lstsq(design, flat, rcond=None)
226
  intercept = coeffs[0] # fitted polynomial evaluated at noise_factor=0
227
  return intercept.reshape(orig_shape)
228
 
229
 
230
+ polynomial_extrapolate_jit = functools.partial(jax.jit, static_argnames=("degree",))(_polynomial_extrapolate_core)
231
+ """`jax.jit`-compiled entry point for `polynomial_extrapolate`, added for
232
+ consistency with every other function in this module (`richardson_extrapolate_jit`,
233
+ `zero_noise_extrapolation_jit`, `uhlmann_fidelity_jit`, `zne_density_matrix_jit`)
234
+ -- until now this was the one function whose `_core` existed (used
235
+ internally by `zne_density_matrix_jit`) but had no standalone public jit
236
+ entry point of its own.
237
+
238
+ `values` must already be cast to its final dtype (complex128 or float64)
239
+ and `lambdas` a float64 array -- this skips `polynomial_extrapolate`'s
240
+ `np.iscomplexobj` auto-detection, not traceable. `degree` is static (same
241
+ constraint as `zne_density_matrix_jit`). Verified to match
242
+ `polynomial_extrapolate` exactly."""
243
+
244
+
245
  def project_to_physical(rho_raw: jnp.ndarray) -> jnp.ndarray:
246
  """Project a Hermitian, trace-1 candidate matrix onto the nearest
247
  physical density matrix (Hermitian, trace 1, positive-semidefinite) in
 
321
  against the previous full-reconstruction version: identical to machine
322
  precision (~1e-16) on 30 random density-matrix pairs.
323
  """
324
+ rho_A = jnp.asarray(rho_A, dtype=jnp.complex128)
325
+ rho_B = jnp.asarray(rho_B, dtype=jnp.complex128)
326
+ return float(_uhlmann_fidelity_core(rho_A, rho_B))
327
+
328
+
329
+ def _uhlmann_fidelity_core(rho_A: jnp.ndarray, rho_B: jnp.ndarray) -> jnp.ndarray:
330
+ """`jax.jit`-traceable core of `uhlmann_fidelity` -- both inputs already
331
+ complex128; returns a jnp scalar instead of a Python `float` (the
332
+ `float()` cast isn't traceable, same reason `_jsd_vectors_jax`/
333
+ `_jsd_vectors` are split this way in `dense_evolution.mps`).
334
+ """
335
  def sqrt_eigvals(m):
336
  w = jnp.linalg.eigvalsh(m)
337
  return jnp.clip(jnp.real(w), 0.0, None)
338
 
 
 
 
339
  w_A, v_A = jnp.linalg.eigh(rho_A)
340
  sqrt_A = (v_A * jnp.sqrt(jnp.clip(jnp.real(w_A), 0.0, None))) @ jnp.conj(v_A).T
341
  inner = sqrt_A @ rho_B @ sqrt_A
342
  inner_evals = sqrt_eigvals(inner)
343
+ return jnp.real(jnp.sum(jnp.sqrt(inner_evals)) ** 2)
344
+
345
+
346
+ uhlmann_fidelity_jit = jax.jit(_uhlmann_fidelity_core)
347
+ """`jax.jit`-compiled entry point for `uhlmann_fidelity`. Both `rho_A`/
348
+ `rho_B` must already be `complex128` (this skips `uhlmann_fidelity`'s
349
+ own `jnp.asarray(..., dtype=jnp.complex128)` cast, itself trace-safe, but
350
+ kept out of the core to mirror the other `_core` functions' convention).
351
+ Returns a jnp scalar, not a Python `float` -- call `float(...)` yourself
352
+ if you need one outside a jitted context. Verified to match `uhlmann_fidelity`
353
+ exactly (same underlying math, just not cast to a Python float)."""
354
 
355
 
356
  def zne_density_matrix(rho_at_scales, noise_factors, degree: int = 2) -> jnp.ndarray:
 
438
  """
439
  extrapolated = polynomial_extrapolate(rho_at_scales, noise_factors, degree=degree)
440
  return project_to_physical(extrapolated)
441
+
442
+
443
+ def _zne_density_matrix_core(rho_at_scales: jnp.ndarray, noise_factors: jnp.ndarray,
444
+ degree: int) -> jnp.ndarray:
445
+ """`jax.jit`-traceable core of `zne_density_matrix` -- `rho_at_scales`
446
+ must already be complex128, `noise_factors` a float64 array; `degree`
447
+ must be a Python int (unrolled at trace time by
448
+ `_polynomial_extrapolate_core`, same constraint as there).
449
+ """
450
+ extrapolated = _polynomial_extrapolate_core(rho_at_scales, noise_factors, degree)
451
+ return project_to_physical(extrapolated)
452
+
453
+
454
+ zne_density_matrix_jit = functools.partial(jax.jit, static_argnames=("degree",))(_zne_density_matrix_core)
455
+ """`jax.jit`-compiled entry point for `zne_density_matrix`, for callers
456
+ inside a jitted pipeline (e.g. `jax.lax.scan` in `MPSSimulator.run_circuit_jit`)
457
+ who don't want a host round-trip every call -- `zne_density_matrix` itself
458
+ stays eager (unchanged) for one-off/interactive use, where jit compilation
459
+ overhead isn't worth paying for a single call.
460
+
461
+ `degree` is a static argument (must be a Python int, not a traced value --
462
+ pass it positionally or by keyword the same way every call, since JAX
463
+ recompiles per distinct static value). `rho_at_scales` must already be
464
+ `complex128` and `noise_factors` a plain float array/sequence -- unlike
465
+ `zne_density_matrix`, this skips the `np.iscomplexobj` dtype auto-detection
466
+ (not traceable) and always assumes complex input, which is the only case
467
+ that makes sense for density matrices.
468
+
469
+ Measured speedup is real but size- and call-pattern-dependent (`project_to_physical`
470
+ alone measured 2x-22x across 2x2 to 32x32 matrices when jitted vs. the
471
+ previous non-jittable version) -- benchmark your own use case rather than
472
+ assuming a fixed number; the benefit only appears once compiled and called
473
+ repeatedly, a single one-off call pays the compilation cost first.
474
+ """
pyproject.toml CHANGED
@@ -4,7 +4,7 @@ build-backend = "setuptools.build_meta"
4
 
5
  [project]
6
  name = "dense-evolution"
7
- version = "8.1.39"
8
  description = "Micro-optimized High-Performance NISQ Statevector Quantum Circuit Simulator (Hardware-Adaptive Integration of Native NumPy, CUDA-Accelerated CuPy, and Linear Kernel Fusion via JAX JIT/XLA Compilation)"
9
  readme = "README.md"
10
  requires-python = ">=3.9"
 
4
 
5
  [project]
6
  name = "dense-evolution"
7
+ version = "8.1.40"
8
  description = "Micro-optimized High-Performance NISQ Statevector Quantum Circuit Simulator (Hardware-Adaptive Integration of Native NumPy, CUDA-Accelerated CuPy, and Linear Kernel Fusion via JAX JIT/XLA Compilation)"
9
  readme = "README.md"
10
  requires-python = ">=3.9"
test_mitigation.py CHANGED
@@ -5,7 +5,9 @@ import pytest
5
  import dense_evolution as de
6
  from dense_evolution.mitigation import (
7
  richardson_extrapolate, zero_noise_extrapolation, polynomial_extrapolate,
8
- project_to_physical, uhlmann_fidelity, zne_density_matrix,
 
 
9
  )
10
 
11
 
@@ -120,6 +122,10 @@ def test_exported_from_package_root():
120
  assert de.project_to_physical is project_to_physical
121
  assert de.uhlmann_fidelity is uhlmann_fidelity
122
  assert de.zne_density_matrix is zne_density_matrix
 
 
 
 
123
 
124
 
125
  def test_polynomial_extrapolate_matches_richardson_at_exact_point_count():
@@ -284,3 +290,180 @@ def test_zne_density_matrix_preserves_complex_off_diagonal_entries():
284
  ])
285
  got = np.asarray(zne_density_matrix(rho_at_scales, [1.0, 2.0, 3.0]))
286
  assert np.any(np.abs(got.imag) > 1e-9)
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
5
  import dense_evolution as de
6
  from dense_evolution.mitigation import (
7
  richardson_extrapolate, zero_noise_extrapolation, polynomial_extrapolate,
8
+ project_to_physical, uhlmann_fidelity, zne_density_matrix, zne_density_matrix_jit,
9
+ richardson_extrapolate_jit, zero_noise_extrapolation_jit, uhlmann_fidelity_jit,
10
+ polynomial_extrapolate_jit,
11
  )
12
 
13
 
 
122
  assert de.project_to_physical is project_to_physical
123
  assert de.uhlmann_fidelity is uhlmann_fidelity
124
  assert de.zne_density_matrix is zne_density_matrix
125
+ assert de.zne_density_matrix_jit is zne_density_matrix_jit
126
+ assert de.richardson_extrapolate_jit is richardson_extrapolate_jit
127
+ assert de.zero_noise_extrapolation_jit is zero_noise_extrapolation_jit
128
+ assert de.uhlmann_fidelity_jit is uhlmann_fidelity_jit
129
 
130
 
131
  def test_polynomial_extrapolate_matches_richardson_at_exact_point_count():
 
290
  ])
291
  got = np.asarray(zne_density_matrix(rho_at_scales, [1.0, 2.0, 3.0]))
292
  assert np.any(np.abs(got.imag) > 1e-9)
293
+
294
+
295
+ def test_zne_density_matrix_jit_matches_eager_exactly():
296
+ rng = np.random.default_rng(20)
297
+ d = 4
298
+ mats = []
299
+ for _ in range(3):
300
+ a = rng.normal(size=(d, d)) + 1j * rng.normal(size=(d, d))
301
+ m = a @ a.conj().T
302
+ mats.append(m / np.trace(m))
303
+ rho_at_scales = jnp.asarray(np.stack(mats), dtype=jnp.complex128)
304
+ noise_factors = jnp.asarray([1.0, 2.0, 3.0], dtype=jnp.float64)
305
+
306
+ eager = zne_density_matrix(rho_at_scales, [1.0, 2.0, 3.0], degree=2)
307
+ jitted = zne_density_matrix_jit(rho_at_scales, noise_factors, degree=2)
308
+ np.testing.assert_array_equal(np.asarray(eager), np.asarray(jitted))
309
+
310
+
311
+ def test_zne_density_matrix_jit_output_is_a_valid_density_matrix():
312
+ rng = np.random.default_rng(21)
313
+ d = 5
314
+ mats = []
315
+ for _ in range(5):
316
+ a = rng.normal(size=(d, d)) + 1j * rng.normal(size=(d, d))
317
+ m = a @ a.conj().T
318
+ mats.append(m / np.trace(m))
319
+ rho_at_scales = jnp.asarray(np.stack(mats), dtype=jnp.complex128)
320
+ noise_factors = jnp.asarray([1.0, 2.0, 3.0, 4.0, 5.0], dtype=jnp.float64)
321
+
322
+ got = np.asarray(zne_density_matrix_jit(rho_at_scales, noise_factors, degree=2))
323
+ np.testing.assert_allclose(got, got.conj().T, atol=1e-9)
324
+ assert np.trace(got).real == pytest.approx(1.0, abs=1e-9)
325
+ assert np.linalg.eigvalsh(got).min() >= -1e-9
326
+
327
+
328
+ def test_zne_density_matrix_jit_actually_compiles_under_jit():
329
+ # zne_density_matrix_jit is already jax.jit-wrapped; this specifically
330
+ # checks it doesn't raise a tracing error (e.g. from a stray
331
+ # np.iscomplexobj/np.asarray call on a traced value) when called
332
+ # through an *additional* outer jax.jit, the realistic case of
333
+ # embedding it inside a larger jitted pipeline (e.g. jax.lax.scan).
334
+ import jax
335
+
336
+ rng = np.random.default_rng(22)
337
+ d = 3
338
+ mats = []
339
+ for _ in range(3):
340
+ a = rng.normal(size=(d, d)) + 1j * rng.normal(size=(d, d))
341
+ m = a @ a.conj().T
342
+ mats.append(m / np.trace(m))
343
+ rho_at_scales = jnp.asarray(np.stack(mats), dtype=jnp.complex128)
344
+ noise_factors = jnp.asarray([1.0, 2.0, 3.0], dtype=jnp.float64)
345
+
346
+ from dense_evolution.mitigation import _zne_density_matrix_core
347
+ import functools
348
+ outer_jit = jax.jit(functools.partial(_zne_density_matrix_core, degree=2))
349
+ result = outer_jit(rho_at_scales, noise_factors)
350
+ result.block_until_ready()
351
+ assert np.trace(np.asarray(result)).real == pytest.approx(1.0, abs=1e-9)
352
+
353
+
354
+ def test_polynomial_extrapolate_jit_matches_eager():
355
+ lambdas = jnp.asarray([1.0, 2.0, 3.0, 4.0, 5.0], dtype=jnp.float64)
356
+ values = jnp.asarray([1 + 2j, 3 + 4j, 3 + 4j, 2 - 1j, 5 + 0.5j], dtype=jnp.complex128)
357
+ got = polynomial_extrapolate_jit(values, lambdas, degree=2)
358
+ expected = polynomial_extrapolate(
359
+ [1 + 2j, 3 + 4j, 3 + 4j, 2 - 1j, 5 + 0.5j], [1.0, 2.0, 3.0, 4.0, 5.0], degree=2)
360
+ np.testing.assert_allclose(np.asarray(got), np.asarray(expected))
361
+
362
+
363
+ def test_polynomial_extrapolate_jit_compiles_under_outer_jit():
364
+ import jax
365
+ import functools
366
+ lambdas = jnp.asarray([1.0, 2.0, 3.0], dtype=jnp.float64)
367
+ values = jnp.asarray([1.0, 2.0, 3.0], dtype=jnp.float64)
368
+ outer_jit = jax.jit(functools.partial(polynomial_extrapolate_jit, degree=2))
369
+ result = outer_jit(values, lambdas)
370
+ result.block_until_ready()
371
+ assert float(result) == pytest.approx(0.0, abs=1e-9) # linear data -> exact intercept 0
372
+
373
+
374
+ def test_richardson_extrapolate_jit_matches_eager():
375
+ lambdas = jnp.asarray([1.0, 2.0, 3.0], dtype=jnp.float64)
376
+ values = jnp.asarray([1 + 2j, 3 + 4j, 3 + 4j], dtype=jnp.complex128)
377
+ got = richardson_extrapolate_jit(values, lambdas)
378
+ expected = richardson_extrapolate([1 + 2j, 3 + 4j, 3 + 4j], [1.0, 2.0, 3.0])
379
+ np.testing.assert_allclose(np.asarray(got), np.asarray(expected))
380
+
381
+
382
+ def test_richardson_extrapolate_jit_compiles_under_outer_jit():
383
+ import jax
384
+ lambdas = jnp.asarray([1.0, 2.0, 3.0], dtype=jnp.float64)
385
+ values = jnp.asarray([1.0, 2.0, 3.0], dtype=jnp.float64)
386
+ outer_jit = jax.jit(richardson_extrapolate_jit)
387
+ result = outer_jit(values, lambdas)
388
+ result.block_until_ready()
389
+ assert float(result) == pytest.approx(0.0, abs=1e-9) # linear data -> exact intercept 0
390
+
391
+
392
+ def test_zero_noise_extrapolation_jit_matches_eager():
393
+ values = jnp.asarray([1 + 2j, 3 + 4j, 3 + 4j], dtype=jnp.complex128)
394
+ sigma = jnp.asarray(7.5, dtype=jnp.float64)
395
+ got = zero_noise_extrapolation_jit(values, sigma, 10.0)
396
+ expected = zero_noise_extrapolation([1 + 2j, 3 + 4j, 3 + 4j], [1.0, 2.0, 3.0],
397
+ sigma_at_base_noise=7.5, target_sigma_ideal=10.0)
398
+ np.testing.assert_allclose(np.asarray(got), np.asarray(expected))
399
+
400
+
401
+ def test_zero_noise_extrapolation_jit_target_sigma_ideal_stays_dynamic():
402
+ # target_sigma_ideal must NOT need to be static -- calculate_delta_preemp
403
+ # uses jnp.where internally, not a Python if, so it's trace-safe as a
404
+ # plain traced float. Regression guard: if this ever needs
405
+ # static_argnames, this test starts raising a tracing error (the
406
+ # primary thing being checked -- no exception on a second call with a
407
+ # different target, no recompilation required). A wide target gap and
408
+ # non-degenerate complex values also confirm the coefficients (and so
409
+ # the result) actually do move, not just "didn't crash".
410
+ import jax
411
+ values = jnp.asarray([1 + 2j, 3 + 4j, 3 + 4j], dtype=jnp.complex128)
412
+ sigma = jnp.asarray(0.5, dtype=jnp.float64)
413
+
414
+ @jax.jit
415
+ def f(values, sigma, target):
416
+ return zero_noise_extrapolation_jit(values, sigma, target)
417
+
418
+ r1 = f(values, sigma, 10.0)
419
+ r2 = f(values, sigma, 1.0) # different target, same compiled function
420
+ assert not jnp.allclose(r1, r2)
421
+
422
+
423
+ def test_uhlmann_fidelity_jit_matches_eager():
424
+ rng = np.random.default_rng(23)
425
+ d = 3
426
+ a = rng.normal(size=(d, d)) + 1j * rng.normal(size=(d, d))
427
+ rho_a = jnp.asarray(a @ a.conj().T / np.trace(a @ a.conj().T), dtype=jnp.complex128)
428
+ b = rng.normal(size=(d, d)) + 1j * rng.normal(size=(d, d))
429
+ rho_b = jnp.asarray(b @ b.conj().T / np.trace(b @ b.conj().T), dtype=jnp.complex128)
430
+
431
+ got = uhlmann_fidelity_jit(rho_a, rho_b)
432
+ expected = uhlmann_fidelity(rho_a, rho_b)
433
+ assert float(got) == pytest.approx(expected, abs=1e-9)
434
+
435
+
436
+ def test_full_pipeline_composes_under_a_single_outer_jax_jit():
437
+ # The realistic case this whole _jit family exists for: several of
438
+ # these functions called together inside ONE outer jax.jit (e.g. a
439
+ # step function passed to jax.lax.scan), not each jitted in isolation.
440
+ import jax
441
+ from dense_evolution.mitigation import (
442
+ _zero_noise_extrapolation_healing_core, _zne_density_matrix_core, _uhlmann_fidelity_core,
443
+ )
444
+
445
+ rng = np.random.default_rng(24)
446
+ d = 3
447
+ mats = []
448
+ for _ in range(3):
449
+ a = rng.normal(size=(d, d)) + 1j * rng.normal(size=(d, d))
450
+ m = a @ a.conj().T
451
+ mats.append(m / np.trace(m))
452
+ rho_at_scales = jnp.asarray(np.stack(mats), dtype=jnp.complex128)
453
+ noise_factors = jnp.asarray([1.0, 2.0, 3.0], dtype=jnp.float64)
454
+ sigma = jnp.asarray(7.5, dtype=jnp.float64)
455
+ rho_target = rho_at_scales[0]
456
+
457
+ @jax.jit
458
+ def full_pipeline(rho_at_scales, noise_factors, sigma, target_sigma, rho_target):
459
+ healed = _zero_noise_extrapolation_healing_core(rho_at_scales, sigma, target_sigma)
460
+ corrected = _zne_density_matrix_core(rho_at_scales, noise_factors, 2)
461
+ fidelity = _uhlmann_fidelity_core(corrected, rho_target)
462
+ return healed, corrected, fidelity
463
+
464
+ healed, corrected, fidelity = full_pipeline(rho_at_scales, noise_factors, sigma, 10.0, rho_target)
465
+ jax.block_until_ready((healed, corrected, fidelity))
466
+
467
+ np.testing.assert_allclose(np.asarray(corrected), np.asarray(corrected).conj().T, atol=1e-9)
468
+ assert np.trace(np.asarray(corrected)).real == pytest.approx(1.0, abs=1e-9)
469
+ assert 0.0 <= float(fidelity) <= 1.0 + 1e-9