Trajectree 0.0.1__py3-none-any.whl → 0.0.3__py3-none-any.whl

This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
Files changed (124) hide show
  1. trajectree/__init__.py +0 -3
  2. trajectree/fock_optics/devices.py +1 -1
  3. trajectree/fock_optics/light_sources.py +2 -2
  4. trajectree/fock_optics/measurement.py +9 -9
  5. trajectree/fock_optics/outputs.py +10 -6
  6. trajectree/fock_optics/utils.py +9 -6
  7. trajectree/sequence/swap.py +5 -4
  8. trajectree/trajectory.py +5 -4
  9. {trajectree-0.0.1.dist-info → trajectree-0.0.3.dist-info}/METADATA +2 -3
  10. trajectree-0.0.3.dist-info/RECORD +16 -0
  11. trajectree/quimb/docs/_pygments/_pygments_dark.py +0 -118
  12. trajectree/quimb/docs/_pygments/_pygments_light.py +0 -118
  13. trajectree/quimb/docs/conf.py +0 -158
  14. trajectree/quimb/docs/examples/ex_mpi_expm_evo.py +0 -62
  15. trajectree/quimb/quimb/__init__.py +0 -507
  16. trajectree/quimb/quimb/calc.py +0 -1491
  17. trajectree/quimb/quimb/core.py +0 -2279
  18. trajectree/quimb/quimb/evo.py +0 -712
  19. trajectree/quimb/quimb/experimental/__init__.py +0 -0
  20. trajectree/quimb/quimb/experimental/autojittn.py +0 -129
  21. trajectree/quimb/quimb/experimental/belief_propagation/__init__.py +0 -109
  22. trajectree/quimb/quimb/experimental/belief_propagation/bp_common.py +0 -397
  23. trajectree/quimb/quimb/experimental/belief_propagation/d1bp.py +0 -316
  24. trajectree/quimb/quimb/experimental/belief_propagation/d2bp.py +0 -653
  25. trajectree/quimb/quimb/experimental/belief_propagation/hd1bp.py +0 -571
  26. trajectree/quimb/quimb/experimental/belief_propagation/hv1bp.py +0 -775
  27. trajectree/quimb/quimb/experimental/belief_propagation/l1bp.py +0 -316
  28. trajectree/quimb/quimb/experimental/belief_propagation/l2bp.py +0 -537
  29. trajectree/quimb/quimb/experimental/belief_propagation/regions.py +0 -194
  30. trajectree/quimb/quimb/experimental/cluster_update.py +0 -286
  31. trajectree/quimb/quimb/experimental/merabuilder.py +0 -865
  32. trajectree/quimb/quimb/experimental/operatorbuilder/__init__.py +0 -15
  33. trajectree/quimb/quimb/experimental/operatorbuilder/operatorbuilder.py +0 -1631
  34. trajectree/quimb/quimb/experimental/schematic.py +0 -7
  35. trajectree/quimb/quimb/experimental/tn_marginals.py +0 -130
  36. trajectree/quimb/quimb/experimental/tnvmc.py +0 -1483
  37. trajectree/quimb/quimb/gates.py +0 -36
  38. trajectree/quimb/quimb/gen/__init__.py +0 -2
  39. trajectree/quimb/quimb/gen/operators.py +0 -1167
  40. trajectree/quimb/quimb/gen/rand.py +0 -713
  41. trajectree/quimb/quimb/gen/states.py +0 -479
  42. trajectree/quimb/quimb/linalg/__init__.py +0 -6
  43. trajectree/quimb/quimb/linalg/approx_spectral.py +0 -1109
  44. trajectree/quimb/quimb/linalg/autoblock.py +0 -258
  45. trajectree/quimb/quimb/linalg/base_linalg.py +0 -719
  46. trajectree/quimb/quimb/linalg/mpi_launcher.py +0 -397
  47. trajectree/quimb/quimb/linalg/numpy_linalg.py +0 -244
  48. trajectree/quimb/quimb/linalg/rand_linalg.py +0 -514
  49. trajectree/quimb/quimb/linalg/scipy_linalg.py +0 -293
  50. trajectree/quimb/quimb/linalg/slepc_linalg.py +0 -892
  51. trajectree/quimb/quimb/schematic.py +0 -1518
  52. trajectree/quimb/quimb/tensor/__init__.py +0 -401
  53. trajectree/quimb/quimb/tensor/array_ops.py +0 -610
  54. trajectree/quimb/quimb/tensor/circuit.py +0 -4824
  55. trajectree/quimb/quimb/tensor/circuit_gen.py +0 -411
  56. trajectree/quimb/quimb/tensor/contraction.py +0 -336
  57. trajectree/quimb/quimb/tensor/decomp.py +0 -1255
  58. trajectree/quimb/quimb/tensor/drawing.py +0 -1646
  59. trajectree/quimb/quimb/tensor/fitting.py +0 -385
  60. trajectree/quimb/quimb/tensor/geometry.py +0 -583
  61. trajectree/quimb/quimb/tensor/interface.py +0 -114
  62. trajectree/quimb/quimb/tensor/networking.py +0 -1058
  63. trajectree/quimb/quimb/tensor/optimize.py +0 -1818
  64. trajectree/quimb/quimb/tensor/tensor_1d.py +0 -4778
  65. trajectree/quimb/quimb/tensor/tensor_1d_compress.py +0 -1854
  66. trajectree/quimb/quimb/tensor/tensor_1d_tebd.py +0 -662
  67. trajectree/quimb/quimb/tensor/tensor_2d.py +0 -5954
  68. trajectree/quimb/quimb/tensor/tensor_2d_compress.py +0 -96
  69. trajectree/quimb/quimb/tensor/tensor_2d_tebd.py +0 -1230
  70. trajectree/quimb/quimb/tensor/tensor_3d.py +0 -2869
  71. trajectree/quimb/quimb/tensor/tensor_3d_tebd.py +0 -46
  72. trajectree/quimb/quimb/tensor/tensor_approx_spectral.py +0 -60
  73. trajectree/quimb/quimb/tensor/tensor_arbgeom.py +0 -3237
  74. trajectree/quimb/quimb/tensor/tensor_arbgeom_compress.py +0 -565
  75. trajectree/quimb/quimb/tensor/tensor_arbgeom_tebd.py +0 -1138
  76. trajectree/quimb/quimb/tensor/tensor_builder.py +0 -5411
  77. trajectree/quimb/quimb/tensor/tensor_core.py +0 -11179
  78. trajectree/quimb/quimb/tensor/tensor_dmrg.py +0 -1472
  79. trajectree/quimb/quimb/tensor/tensor_mera.py +0 -204
  80. trajectree/quimb/quimb/utils.py +0 -892
  81. trajectree/quimb/tests/__init__.py +0 -0
  82. trajectree/quimb/tests/test_accel.py +0 -501
  83. trajectree/quimb/tests/test_calc.py +0 -788
  84. trajectree/quimb/tests/test_core.py +0 -847
  85. trajectree/quimb/tests/test_evo.py +0 -565
  86. trajectree/quimb/tests/test_gen/__init__.py +0 -0
  87. trajectree/quimb/tests/test_gen/test_operators.py +0 -361
  88. trajectree/quimb/tests/test_gen/test_rand.py +0 -296
  89. trajectree/quimb/tests/test_gen/test_states.py +0 -261
  90. trajectree/quimb/tests/test_linalg/__init__.py +0 -0
  91. trajectree/quimb/tests/test_linalg/test_approx_spectral.py +0 -368
  92. trajectree/quimb/tests/test_linalg/test_base_linalg.py +0 -351
  93. trajectree/quimb/tests/test_linalg/test_mpi_linalg.py +0 -127
  94. trajectree/quimb/tests/test_linalg/test_numpy_linalg.py +0 -84
  95. trajectree/quimb/tests/test_linalg/test_rand_linalg.py +0 -134
  96. trajectree/quimb/tests/test_linalg/test_slepc_linalg.py +0 -283
  97. trajectree/quimb/tests/test_tensor/__init__.py +0 -0
  98. trajectree/quimb/tests/test_tensor/test_belief_propagation/__init__.py +0 -0
  99. trajectree/quimb/tests/test_tensor/test_belief_propagation/test_d1bp.py +0 -39
  100. trajectree/quimb/tests/test_tensor/test_belief_propagation/test_d2bp.py +0 -67
  101. trajectree/quimb/tests/test_tensor/test_belief_propagation/test_hd1bp.py +0 -64
  102. trajectree/quimb/tests/test_tensor/test_belief_propagation/test_hv1bp.py +0 -51
  103. trajectree/quimb/tests/test_tensor/test_belief_propagation/test_l1bp.py +0 -142
  104. trajectree/quimb/tests/test_tensor/test_belief_propagation/test_l2bp.py +0 -101
  105. trajectree/quimb/tests/test_tensor/test_circuit.py +0 -816
  106. trajectree/quimb/tests/test_tensor/test_contract.py +0 -67
  107. trajectree/quimb/tests/test_tensor/test_decomp.py +0 -40
  108. trajectree/quimb/tests/test_tensor/test_mera.py +0 -52
  109. trajectree/quimb/tests/test_tensor/test_optimizers.py +0 -488
  110. trajectree/quimb/tests/test_tensor/test_tensor_1d.py +0 -1171
  111. trajectree/quimb/tests/test_tensor/test_tensor_2d.py +0 -606
  112. trajectree/quimb/tests/test_tensor/test_tensor_2d_tebd.py +0 -144
  113. trajectree/quimb/tests/test_tensor/test_tensor_3d.py +0 -123
  114. trajectree/quimb/tests/test_tensor/test_tensor_arbgeom.py +0 -226
  115. trajectree/quimb/tests/test_tensor/test_tensor_builder.py +0 -441
  116. trajectree/quimb/tests/test_tensor/test_tensor_core.py +0 -2066
  117. trajectree/quimb/tests/test_tensor/test_tensor_dmrg.py +0 -388
  118. trajectree/quimb/tests/test_tensor/test_tensor_spectral_approx.py +0 -63
  119. trajectree/quimb/tests/test_tensor/test_tensor_tebd.py +0 -270
  120. trajectree/quimb/tests/test_utils.py +0 -85
  121. trajectree-0.0.1.dist-info/RECORD +0 -126
  122. {trajectree-0.0.1.dist-info → trajectree-0.0.3.dist-info}/WHEEL +0 -0
  123. {trajectree-0.0.1.dist-info → trajectree-0.0.3.dist-info}/licenses/LICENSE +0 -0
  124. {trajectree-0.0.1.dist-info → trajectree-0.0.3.dist-info}/top_level.txt +0 -0
@@ -1,261 +0,0 @@
1
- from pytest import mark
2
- import numpy as np
3
- from numpy.testing import assert_allclose
4
- from quimb import (
5
- tr,
6
- eye,
7
- chop,
8
- ikron,
9
- expec,
10
- ptr,
11
- eigh,
12
- groundstate,
13
- concurrence,
14
- basis_vec,
15
- up,
16
- down,
17
- plus,
18
- minus,
19
- yplus,
20
- yminus,
21
- thermal_state,
22
- neel_state,
23
- ham_j1j2,
24
- rand_herm,
25
- graph_state_1d,
26
- pauli,
27
- levi_civita,
28
- bloch_state,
29
- bell_state,
30
- singlet,
31
- singlet_pairs,
32
- werner_state,
33
- ghz_state,
34
- w_state,
35
- perm_state,
36
- )
37
-
38
-
39
- class TestBasisVec:
40
- def test_basis_vec(self):
41
- x = basis_vec(1, 2)
42
- assert_allclose(x, [[0.0], [1.0]])
43
- x = basis_vec(1, 2, qtype="b")
44
- assert_allclose(x, [[0.0, 1.0]])
45
-
46
-
47
- class TestBasicStates:
48
- def test_up(self):
49
- p = up(qtype="dop")
50
- assert_allclose(tr(p @ pauli("z")), 1.0)
51
-
52
- def test_down(self):
53
- p = down(qtype="dop")
54
- assert_allclose(tr(p @ pauli("z")), -1.0)
55
-
56
- def test_plus(self):
57
- p = plus(qtype="dop")
58
- assert_allclose(tr(p @ pauli("x")), 1.0)
59
-
60
- def test_minus(self):
61
- p = minus(qtype="dop")
62
- assert_allclose(tr(p @ pauli("x")), -1.0)
63
-
64
- def test_yplus(self):
65
- p = yplus(qtype="dop")
66
- assert_allclose(tr(p @ pauli("y")), 1.0)
67
-
68
- def test_yminus(self):
69
- p = yminus(qtype="dop")
70
- assert_allclose(tr(p @ pauli("y")), -1.0)
71
-
72
-
73
- class TestBlochState:
74
- def test_pure(self):
75
- for vec, op, val in zip(
76
- (
77
- (1, 0, 0),
78
- (0, 1, 0),
79
- (0, 0, 1),
80
- (-1, 0, 0),
81
- (0, -1, 0),
82
- (0, 0, -1),
83
- ),
84
- ("x", "y", "z", "x", "y", "z"),
85
- (1, 1, 1, -1, -1, -1),
86
- ):
87
- x = tr(bloch_state(*vec) @ pauli(op))
88
- assert_allclose(x, val)
89
-
90
- def test_mixed(self):
91
- for vec, op, val in zip(
92
- (
93
- (0.5, 0, 0),
94
- (0, 0.5, 0),
95
- (0, 0, 0.5),
96
- (-0.5, 0, 0),
97
- (0, -0.5, 0),
98
- (0, 0, -0.5),
99
- ),
100
- ("x", "y", "z", "x", "y", "z"),
101
- (0.5, 0.5, 0.5, -0.5, -0.5, -0.5),
102
- ):
103
- x = tr(bloch_state(*vec) @ pauli(op))
104
- assert_allclose(x, val)
105
-
106
- def test_purify(self):
107
- for vec, op, val in zip(
108
- (
109
- (0.5, 0, 0),
110
- (0, 0.5, 0),
111
- (0, 0, 0.5),
112
- (-0.5, 0, 0),
113
- (0, -0.5, 0),
114
- (0, 0, -0.5),
115
- ),
116
- ("x", "y", "z", "x", "y", "z"),
117
- (1, 1, 1, -1, -1, -1),
118
- ):
119
- x = tr(bloch_state(*vec, purified=True) @ pauli(op))
120
- assert_allclose(x, val)
121
-
122
-
123
- class TestBellStates:
124
- def test_bell_states(self):
125
- for s, dic in zip(
126
- ("psi-", "psi+", "phi+", "phi-"),
127
- ({"qtype": "dop"}, {}, {"sparse": True}, {}),
128
- ):
129
- p = bell_state(s, **dic)
130
- assert_allclose(expec(p, p), 1.0)
131
- pa = ptr(p, [2, 2], 0)
132
- assert_allclose(expec(pa, pa), 0.5)
133
-
134
- def test_bell_state_singlet(self):
135
- p = singlet(qtype="dop", sparse=True)
136
- assert_allclose(expec(p, p), 1.0)
137
- pa = ptr(p, [2, 2], 0)
138
- assert_allclose(expec(pa, pa), 0.5)
139
-
140
-
141
- class TestThermalState:
142
- def test_thermal_state_normalization(self):
143
- full = rand_herm(2**4)
144
- for beta in (0, 0.5, 1, 10):
145
- rhoth = thermal_state(full, beta)
146
- assert_allclose(tr(rhoth), 1)
147
-
148
- def test_thermal_state_tuple(self):
149
- full = rand_herm(2**4)
150
- l, v = eigh(full)
151
- for beta in (0, 0.5, 1, 10):
152
- rhoth1 = thermal_state(full, beta)
153
- rhoth2 = thermal_state((l, v), beta)
154
- assert_allclose(rhoth1, rhoth2)
155
-
156
- def test_thermal_state_hot(self):
157
- full = rand_herm(2**4)
158
- rhoth = chop(thermal_state(full, 0.0))
159
- assert_allclose(rhoth, eye(2**4) / 2**4)
160
-
161
- def test_thermal_state_cold(self):
162
- full = ham_j1j2(4, j2=0.1253)
163
- rhoth = thermal_state(full, 100)
164
- gs = groundstate(full)
165
- assert_allclose(tr(gs.H @ rhoth @ gs), 1.0, rtol=1e-4)
166
-
167
- def test_thermal_state_precomp(self):
168
- full = rand_herm(2**4)
169
- beta = 0.624
170
- rhoth1 = thermal_state(full, beta)
171
- func = thermal_state(full, None, precomp_func=True)
172
- rhoth2 = func(beta)
173
- assert_allclose(rhoth1, rhoth2)
174
-
175
-
176
- class TestNeelState:
177
- def test_simple(self):
178
- p = neel_state(1)
179
- assert_allclose(p, up())
180
- p = neel_state(2)
181
- assert_allclose(p, up() & down())
182
- p = neel_state(3)
183
- assert_allclose(p, up() & down() & up())
184
-
185
-
186
- class TestSingletPairs:
187
- def test_n2(self):
188
- p = singlet_pairs(2)
189
- assert_allclose(p, bell_state("psi-"))
190
- p = singlet_pairs(4)
191
- assert_allclose(p, bell_state("psi-") & bell_state("psi-"))
192
-
193
-
194
- class TestWernerState:
195
- def test_extremes(self):
196
- p = werner_state(1)
197
- assert_allclose(p, bell_state("psi-", qtype="dop"))
198
- p = werner_state(0)
199
- assert_allclose(p, eye(4) / 4, atol=1e-14)
200
-
201
- @mark.parametrize("p", np.linspace(0, 1 / 3, 10))
202
- def test_no_entanglement(self, p):
203
- rho = werner_state(p)
204
- assert concurrence(rho) < 1e-14
205
-
206
- @mark.parametrize("p", np.linspace(1 / 3 + 0.001, 1.0, 10))
207
- def test_entanglement(self, p):
208
- rho = werner_state(p)
209
- assert concurrence(rho) > 1e-14
210
-
211
-
212
- class TestGHZState:
213
- def test_n2(self):
214
- p = ghz_state(2)
215
- assert_allclose(p, bell_state("phi+"))
216
-
217
-
218
- class TestWState:
219
- def test_n2(self):
220
- p = w_state(2)
221
- assert_allclose(p, bell_state("psi+"))
222
-
223
-
224
- class TestLeviCivita:
225
- def test_levi_civita_pos(self):
226
- perm = [0, 1, 2, 3]
227
- assert levi_civita(perm) == 1
228
- perm = [2, 3, 0, 1]
229
- assert levi_civita(perm) == 1
230
-
231
- def test_levi_civita_neg(self):
232
- perm = [0, 2, 1, 3]
233
- assert levi_civita(perm) == -1
234
- perm = [2, 3, 1, 0]
235
- assert levi_civita(perm) == -1
236
-
237
- def test_levi_civita_nzero(self):
238
- perm = [2, 3, 1, 1]
239
- assert levi_civita(perm) == 0
240
- perm = [0, 0, 1, 1]
241
- assert levi_civita(perm) == 0
242
-
243
-
244
- class TestPermState:
245
- def test_n2(self):
246
- p = perm_state([up(), down()])
247
- assert_allclose(p, bell_state("psi-"))
248
-
249
-
250
- class TestGraphState:
251
- def test_graph_state_1d(self):
252
- n = 5
253
- p = graph_state_1d(n, cyclic=True)
254
- for j in range(n):
255
- k = ikron(
256
- [pauli("x"), pauli("z"), pauli("z")],
257
- dims=[2] * n,
258
- inds=(j, (j - 1) % n, (j + 1) % n),
259
- )
260
- o = p.H @ k @ p
261
- np.testing.assert_allclose(o, 1)
File without changes
@@ -1,368 +0,0 @@
1
- import pytest
2
- import numpy as np
3
- from numpy.testing import assert_allclose
4
-
5
- from quimb import (
6
- prod,
7
- rand_ket,
8
- rand_pos,
9
- rand_herm,
10
- partial_transpose,
11
- eigvalsh,
12
- neel_state,
13
- ham_heis,
14
- logneg,
15
- negativity,
16
- entropy,
17
- can_use_mpi_pool,
18
- )
19
- from quimb.utils import last
20
-
21
- from quimb.linalg.approx_spectral import (
22
- lazy_ptr_ppt_linop,
23
- construct_lanczos_tridiag,
24
- lanczos_tridiag_eig,
25
- approx_spectral_function,
26
- lazy_ptr_linop,
27
- tr_abs_approx,
28
- tr_exp_approx,
29
- tr_sqrt_approx,
30
- tr_xlogx_approx,
31
- entropy_subsys_approx,
32
- logneg_subsys_approx,
33
- negativity_subsys_approx,
34
- norm_fro,
35
- norm_fro_approx,
36
- )
37
-
38
- MPI_PARALLEL = [False]
39
- if can_use_mpi_pool():
40
- MPI_PARALLEL.append(True)
41
-
42
-
43
- np.random.seed(42)
44
-
45
- DIMS = [5, 6, 7]
46
- DIMS_MB = [2] * 11
47
-
48
-
49
- @pytest.fixture
50
- def psi_abc():
51
- return rand_ket(prod(DIMS))
52
-
53
-
54
- @pytest.fixture
55
- def psi_ab():
56
- return rand_ket(prod(DIMS[:-1]))
57
-
58
-
59
- @pytest.fixture
60
- def psi_ab_mat():
61
- return np.concatenate(
62
- [rand_ket(prod(DIMS[:-1])) for _ in range(6)], axis=1
63
- )
64
-
65
-
66
- @pytest.fixture
67
- def psi_mb_abc():
68
- return rand_ket(prod(DIMS_MB))
69
-
70
-
71
- @pytest.fixture
72
- def psi_mb_ab():
73
- return rand_ket(prod(DIMS_MB[:7]))
74
-
75
-
76
- @pytest.fixture
77
- def psi_mb_ab_mat():
78
- return np.concatenate(
79
- [rand_ket(prod(DIMS_MB[:7])) for _ in range(6)], axis=1
80
- )
81
-
82
-
83
- class TestLazyTensorEval:
84
- # ------------------------- Just partial trace -------------------------- #
85
-
86
- def test_lazy_ptr_dot_simple_linear_op(self, psi_abc, psi_ab):
87
- rho_ab = psi_abc.ptr(DIMS, [0, 1])
88
- psi_out_expected = rho_ab @ psi_ab
89
- lo = lazy_ptr_linop(psi_abc, DIMS, [0, 1])
90
- assert hasattr(lo, "H")
91
- assert lo.dtype == complex
92
- assert lo.shape == (DIMS[0] * DIMS[1], DIMS[0] * DIMS[1])
93
- psi_out_got = lo @ psi_ab
94
- assert_allclose(psi_out_expected, psi_out_got)
95
-
96
- def test_lazy_ptr_dot_mat_simple_linear_op(self, psi_abc, psi_ab_mat):
97
- rho_ab = psi_abc.ptr(DIMS, [0, 1])
98
- psi_out_expected = rho_ab @ psi_ab_mat
99
- lo = lazy_ptr_linop(psi_abc, DIMS, [0, 1])
100
- psi_out_got = lo @ psi_ab_mat
101
- assert_allclose(psi_out_expected, psi_out_got)
102
-
103
- def test_lazy_ptr_dot_manybody_linear_op(self, psi_mb_abc, psi_mb_ab):
104
- sysa = [0, 1, 2, 3, 7, 8, 9]
105
- rho_ab = psi_mb_abc.ptr(DIMS_MB, sysa)
106
- psi_out_expected = rho_ab @ psi_mb_ab
107
- lo = lazy_ptr_linop(psi_mb_abc, DIMS_MB, sysa=sysa)
108
- assert hasattr(lo, "H")
109
- assert lo.dtype == complex
110
- assert lo.shape == (128, 128)
111
- psi_out_got = lo @ psi_mb_ab
112
- assert_allclose(psi_out_expected, psi_out_got)
113
-
114
- def test_lazy_ptr_dot_mat_manybody_linear_op(
115
- self, psi_mb_abc, psi_mb_ab_mat
116
- ):
117
- sysa = [0, 1, 2, 3, 7, 8, 9]
118
- rho_ab = psi_mb_abc.ptr(DIMS_MB, sysa)
119
- psi_out_expected = rho_ab @ psi_mb_ab_mat
120
- lo = lazy_ptr_linop(psi_mb_abc, DIMS_MB, sysa=sysa)
121
- psi_out_got = lo @ psi_mb_ab_mat
122
- assert_allclose(psi_out_expected, psi_out_got)
123
-
124
- # ----------------- partial trace and partial transpose ----------------- #
125
-
126
- def test_lazy_ptr_ppt_dot_linear_op(self, psi_abc, psi_ab):
127
- rho_ab = psi_abc.ptr(DIMS, [0, 1])
128
- rho_ab_pt = partial_transpose(rho_ab, DIMS[:-1])
129
- psi_out_expected = rho_ab_pt @ psi_ab
130
- lo = lazy_ptr_ppt_linop(psi_abc, DIMS, 0, 1)
131
- assert hasattr(lo, "H")
132
- assert lo.dtype == complex
133
- assert lo.shape == (DIMS[0] * DIMS[1], DIMS[0] * DIMS[1])
134
- psi_out_got = lo @ psi_ab
135
- assert_allclose(psi_out_expected, psi_out_got)
136
-
137
- def test_lazy_ptr_ppt_dot_mat_linear_op(self, psi_abc, psi_ab_mat):
138
- rho_ab = psi_abc.ptr(DIMS, [0, 1])
139
- rho_ab_pt = partial_transpose(rho_ab, DIMS[:-1])
140
- psi_out_expected = rho_ab_pt @ psi_ab_mat
141
- lo = lazy_ptr_ppt_linop(psi_abc, DIMS, 0, 1)
142
- psi_out_got = lo @ psi_ab_mat
143
- assert_allclose(psi_out_expected, psi_out_got)
144
-
145
- def test_lazy_ptr_ppt_dot_manybody_linear_op(self, psi_mb_abc, psi_mb_ab):
146
- sysa = [0, 1, 7, 8]
147
- sysb = [2, 3, 9]
148
- rho_ab = psi_mb_abc.ptr(DIMS_MB, sysa + sysb)
149
- rho_ab = partial_transpose(rho_ab, [2] * 7, sysa=(0, 1, 4, 5))
150
- psi_out_expected = rho_ab @ psi_mb_ab
151
- lo = lazy_ptr_ppt_linop(psi_mb_abc, DIMS_MB, sysa, sysb)
152
- assert hasattr(lo, "H")
153
- assert lo.dtype == complex
154
- assert lo.shape == (128, 128)
155
- psi_out_got = lo.dot(psi_mb_ab)
156
- assert_allclose(psi_out_expected, psi_out_got)
157
-
158
- def test_lazy_ptr_ppt_dot_mat_manybody_linear_op(
159
- self, psi_mb_abc, psi_mb_ab_mat
160
- ):
161
- sysa = [0, 1, 7, 8]
162
- sysb = [2, 3, 9]
163
- rho_ab = psi_mb_abc.ptr(DIMS_MB, sysa + sysb)
164
- rho_ab = partial_transpose(rho_ab, [2] * 7, sysa=(0, 1, 4, 5))
165
- psi_out_expected = rho_ab @ psi_mb_ab_mat
166
- lo = lazy_ptr_ppt_linop(psi_mb_abc, DIMS_MB, sysa, sysb)
167
- psi_out_got = lo.dot(psi_mb_ab_mat)
168
- assert psi_out_got.shape[1] > 1
169
- assert_allclose(psi_out_expected, psi_out_got)
170
-
171
-
172
- # --------------------- Test lanczos spectral functions --------------------- #
173
-
174
-
175
- def np_sqrt(x):
176
- out = np.empty_like(x)
177
- mtz = x > 0
178
- out[~mtz] = 0.0
179
- out[mtz] = np.sqrt(x[mtz])
180
- return out
181
-
182
-
183
- def np_xlogx(x):
184
- out = np.empty_like(x)
185
- mtz = x > 0
186
- out[~mtz] = 0.0
187
- out[mtz] = x[mtz] * np.log2(x[mtz])
188
- return out
189
-
190
-
191
- class TestLanczosApprox:
192
- @pytest.mark.parametrize("bsz", [1, 2, 5])
193
- def test_construct_lanczos_tridiag(self, bsz):
194
- a = rand_herm(2**5)
195
- alpha, beta, scaling = last(
196
- construct_lanczos_tridiag(a, bsz=bsz, K=20)
197
- )
198
- assert alpha.shape == (20,)
199
- assert beta.shape == (20,)
200
-
201
- el, ev = lanczos_tridiag_eig(alpha, beta)
202
- assert el.shape == (20,)
203
- assert el.dtype == float
204
- assert ev.shape == (20, 20)
205
- assert ev.dtype == float
206
-
207
- @pytest.mark.parametrize("bsz", [1, 2, 5])
208
- def test_construct_lanczos_tridiag_beta_breakdown(self, bsz):
209
- a = rand_herm(8)
210
- alpha, beta, scaling = last(construct_lanczos_tridiag(a, bsz=bsz, K=9))
211
- assert alpha.shape == (8,)
212
- assert beta.shape == (8,)
213
-
214
- el, ev = lanczos_tridiag_eig(alpha, beta)
215
- assert el.shape == (8,)
216
- assert el.dtype == float
217
- assert ev.shape == (8, 8)
218
- assert ev.dtype == float
219
-
220
- @pytest.mark.parametrize("mpi", MPI_PARALLEL)
221
- @pytest.mark.parametrize("bsz", [1, 2, 5])
222
- @pytest.mark.parametrize(
223
- "fn_matrix_rtol",
224
- [
225
- (np.abs, rand_herm, 1e-1),
226
- (np.sqrt, rand_pos, 1e-1),
227
- (np.log1p, rand_pos, 2e-1),
228
- (np.exp, rand_herm, 1e-1),
229
- ],
230
- )
231
- def test_approx_spectral_function(self, fn_matrix_rtol, bsz, mpi):
232
- fn, matrix, rtol = fn_matrix_rtol
233
- a = matrix(2**7)
234
- pos = fn == np.sqrt
235
- actual_x = sum(fn(eigvalsh(a)))
236
- approx_x = approx_spectral_function(
237
- a, fn, mpi=mpi, pos=pos, bsz=bsz, verbosity=2
238
- )
239
- assert_allclose(actual_x, approx_x, rtol=rtol)
240
-
241
- @pytest.mark.parametrize("bsz", [1, 2, 5])
242
- @pytest.mark.parametrize("dist", ["gaussian", "phase", "rademacher"])
243
- @pytest.mark.parametrize(
244
- "fn_matrix_rtol",
245
- [
246
- (np.abs, rand_herm, 2e-1),
247
- (np.sqrt, rand_pos, 2e-1),
248
- (np.log1p, rand_pos, 3e-1),
249
- (np.exp, rand_herm, 2e-1),
250
- ],
251
- )
252
- def test_approx_spectral_function_with_v0(self, dist, fn_matrix_rtol, bsz):
253
- fn, matrix, rtol = fn_matrix_rtol
254
- a = matrix(2**7)
255
- actual_x = sum(fn(eigvalsh(a)))
256
- # check un-normalized state work properly
257
- v0 = neel_state(7) + neel_state(7, down_first=True)
258
- v0 = v0.toarray().reshape(-1)
259
- pos = fn == np.sqrt
260
- v0_opts = {"dist": dist, "orthog": True}
261
- approx_x = approx_spectral_function(
262
- a, fn, v0=v0, pos=pos, bsz=bsz, K=20, verbosity=2, v0_opts=v0_opts
263
- )
264
- assert_allclose(actual_x, approx_x, rtol=rtol)
265
-
266
- @pytest.mark.parametrize("bsz", [1, 2, 5])
267
- @pytest.mark.parametrize(
268
- "fn_approx_rtol",
269
- [
270
- (np_sqrt, tr_sqrt_approx, 0.3),
271
- (np.exp, tr_exp_approx, 0.03),
272
- (np_xlogx, tr_xlogx_approx, 0.3),
273
- ],
274
- )
275
- def test_approx_spectral_function_ptr_lin_op(
276
- self, fn_approx_rtol, psi_abc, psi_ab, bsz
277
- ):
278
- fn, approx, rtol = fn_approx_rtol
279
- sysa = [0, 1]
280
- rho_ab = psi_abc.ptr(DIMS, sysa)
281
- actual_x = sum(fn(eigvalsh(rho_ab)))
282
- lo = lazy_ptr_linop(psi_abc, DIMS, sysa)
283
- approx_x = approx(lo, R=50, bsz=bsz, verbosity=2)
284
- assert_allclose(actual_x, approx_x, rtol=rtol)
285
-
286
- @pytest.mark.parametrize("bsz", [1, 2, 5])
287
- @pytest.mark.parametrize(
288
- "fn_approx_rtol",
289
- [(np.exp, tr_exp_approx, 5e-2), (np.abs, tr_abs_approx, 1e-1)],
290
- )
291
- def test_approx_spectral_function_ptr_ppt_lin_op(
292
- self, fn_approx_rtol, psi_abc, psi_ab, bsz
293
- ):
294
- fn, approx, rtol = fn_approx_rtol
295
- rho_ab_ppt = partial_transpose(psi_abc.ptr(DIMS, [0, 1]), DIMS[:-1], 0)
296
- actual_x = sum(fn(eigvalsh(rho_ab_ppt)))
297
- lo = lazy_ptr_ppt_linop(psi_abc, DIMS, sysa=0, sysb=1)
298
- approx_x = approx_spectral_function(lo, fn, K=20, R=20, bsz=bsz)
299
- assert_allclose(actual_x, approx_x, rtol=rtol)
300
-
301
- @pytest.mark.parametrize("bsz", [1, 2, 5])
302
- def test_approx_spectral_subspaces_with_heis_partition(self, bsz):
303
- h = ham_heis(10, sparse=True)
304
- beta = 0.01
305
- actual_Z = sum(np.exp(-beta * eigvalsh(h.toarray())))
306
- approx_Z = tr_exp_approx(-beta * h, bsz=bsz)
307
- assert_allclose(actual_Z, approx_Z, rtol=3e-2)
308
-
309
- def test_approx_spectral_plot(self):
310
- import matplotlib
311
-
312
- matplotlib.use("Template")
313
- X = rand_herm(1000, sparse=True)
314
- approx_spectral_function(X, lambda x: abs(x), plot=True)
315
-
316
-
317
- # ------------------------ Test specific quantities ------------------------- #
318
-
319
-
320
- class TestSpecificApproxQuantities:
321
- @pytest.mark.parametrize("bsz", [1, 2, 5])
322
- def test_entropy_approx_simple(self, psi_abc, bsz):
323
- np.random.seed(42)
324
- rho_ab = psi_abc.ptr(DIMS, [0, 1])
325
- actual_e = entropy(rho_ab)
326
- approx_e = entropy_subsys_approx(psi_abc, DIMS, [0, 1], bsz=bsz, R=20)
327
- assert_allclose(actual_e, approx_e, rtol=2e-1)
328
-
329
- @pytest.mark.parametrize("bsz", [1, 2, 5])
330
- def test_entropy_approx_many_body(self, psi_mb_abc, bsz):
331
- rho_ab = psi_mb_abc.ptr(DIMS_MB, [0, 1, 7, 8, 2, 3, 9])
332
- actual_e = entropy(rho_ab)
333
- approx_e = entropy_subsys_approx(
334
- psi_mb_abc, DIMS_MB, [0, 1, 7, 8, 2, 3, 9], bsz=bsz
335
- )
336
- assert_allclose(actual_e, approx_e, rtol=2e-1)
337
-
338
- @pytest.mark.parametrize("bsz", [1, 2, 5])
339
- def test_logneg_approx_simple(self, psi_abc, bsz):
340
- rho_ab = psi_abc.ptr(DIMS, [0, 1])
341
- actual_ln = logneg(rho_ab, DIMS[:-1], 0)
342
- approx_ln = logneg_subsys_approx(psi_abc, DIMS, 0, 1, bsz=bsz)
343
- assert_allclose(actual_ln, approx_ln, rtol=2e-1)
344
-
345
- @pytest.mark.parametrize("bsz", [1, 2, 5])
346
- def test_logneg_approx_many_body(self, psi_mb_abc, bsz):
347
- sysa = [0, 1, 7, 8]
348
- sysb = [2, 3, 9]
349
- rho_ab = psi_mb_abc.ptr(DIMS_MB, sysa + sysb)
350
- actual_ln = logneg(rho_ab, [2] * 7, sysa=(0, 1, 4, 5))
351
- approx_ln = logneg_subsys_approx(
352
- psi_mb_abc, DIMS_MB, sysa=sysa, sysb=sysb, bsz=bsz
353
- )
354
- assert_allclose(actual_ln, approx_ln, rtol=1e-1)
355
-
356
- @pytest.mark.parametrize("bsz", [1, 2, 5])
357
- def test_negativity_approx_simple(self, psi_abc, bsz):
358
- rho_ab = psi_abc.ptr(DIMS, [0, 1])
359
- actual_neg = negativity(rho_ab, DIMS[:-1], 0)
360
- approx_neg = negativity_subsys_approx(psi_abc, DIMS, 0, 1, bsz=bsz)
361
- assert_allclose(actual_neg, approx_neg, rtol=2e-1)
362
-
363
- @pytest.mark.parametrize("bsz", [1, 2, 5])
364
- def test_norm_fro_approx(self, bsz):
365
- A = rand_herm(2**5)
366
- actual_norm_fro = norm_fro(A)
367
- approx_norm_fro = norm_fro_approx(A, tol=1e-2, bsz=bsz)
368
- assert_allclose(actual_norm_fro, approx_norm_fro, rtol=1e-1)