ffsim 0.0.74__tar.gz → 0.0.76__tar.gz
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.
- {ffsim-0.0.74 → ffsim-0.0.76}/.github/workflows/build-and-release.yml +0 -2
- {ffsim-0.0.74 → ffsim-0.0.76}/.github/workflows/check.yml +1 -1
- {ffsim-0.0.74 → ffsim-0.0.76}/.github/workflows/docs-dev.yml +1 -1
- {ffsim-0.0.74 → ffsim-0.0.76}/.github/workflows/docs-release.yml +1 -1
- {ffsim-0.0.74 → ffsim-0.0.76}/.github/workflows/test-latest-versions.yml +0 -6
- {ffsim-0.0.74 → ffsim-0.0.76}/.github/workflows/test-minimum-versions.yml +0 -3
- ffsim-0.0.76/Cargo.lock +319 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/Cargo.toml +0 -6
- {ffsim-0.0.74 → ffsim-0.0.76}/PKG-INFO +17 -5
- {ffsim-0.0.74 → ffsim-0.0.76}/README.md +16 -4
- ffsim-0.0.76/docs/_static/logo-dark.svg +1 -0
- ffsim-0.0.76/docs/_static/logo.svg +1 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/docs/conf.py +6 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/docs/explanations/variational-ansatzes.ipynb +1 -1
- {ffsim-0.0.74 → ffsim-0.0.76}/docs/how-to-guides/qiskit-lucj.ipynb +93 -30
- {ffsim-0.0.74 → ffsim-0.0.76}/docs/index.md +14 -0
- ffsim-0.0.76/docs/install.md +43 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/docs/tutorials/double-factorized-trotter.ipynb +1 -1
- {ffsim-0.0.74 → ffsim-0.0.76}/pyproject.toml +2 -2
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/_lib.pyi +2 -2
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/linalg/givens.py +3 -2
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/operators/coupled_cluster.py +12 -12
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/qiskit/__init__.py +2 -2
- ffsim-0.0.76/python/ffsim/qiskit/lucj_pass_manager.py +521 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/qiskit/transpiler_passes/__init__.py +1 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/states/slater.py +85 -32
- {ffsim-0.0.74 → ffsim-0.0.76}/src/gates/orbital_rotation.rs +2 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/src/gates/phase_shift.rs +2 -14
- {ffsim-0.0.74 → ffsim-0.0.76}/src/jordan_wigner.rs +1 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/src/linalg/givens.rs +7 -8
- ffsim-0.0.76/tests/python/qiskit/lucj_pass_manager_test.py +223 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/states/slater_test.py +58 -32
- {ffsim-0.0.74 → ffsim-0.0.76}/uv.lock +1407 -1066
- ffsim-0.0.74/Cargo.lock +0 -1067
- ffsim-0.0.74/docs/install.md +0 -65
- {ffsim-0.0.74 → ffsim-0.0.76}/.dockerignore +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/.github/workflows/docker.yml +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/.gitignore +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/.pre-commit-config.yaml +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/CONTRIBUTING.md +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/Dockerfile +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/LICENSE +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/compose.yaml +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/docs/_templates/autosummary/class.rst +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/docs/explanations/diag-coulomb-hamiltonian.ipynb +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/docs/explanations/double-factorized.ipynb +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/docs/explanations/fermion-operator.ipynb +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/docs/explanations/hamiltonians.ipynb +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/docs/explanations/index.md +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/docs/explanations/lucj.ipynb +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/docs/explanations/orbital-rotation.ipynb +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/docs/explanations/protocols.ipynb +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/docs/explanations/qubit-gate-decompositions.ipynb +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/docs/explanations/state-vectors-and-gates.ipynb +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/docs/generate_api_docs.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/docs/how-to-guides/compute-expectation-values.ipynb +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/docs/how-to-guides/entanglement-forging.ipynb +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/docs/how-to-guides/index.md +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/docs/how-to-guides/qiskit-circuits-sim.ipynb +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/docs/how-to-guides/qiskit-merge-orbital-rotations.ipynb +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/docs/how-to-guides/qiskit-trotter.ipynb +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/docs/how-to-guides/sample-from-state-vectors.ipynb +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/docs/how-to-guides/sample-slater.ipynb +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/docs/how-to-guides/simulate-trotter-hubbard.ipynb +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/docs/how-to-guides/simulate-trotter-mol-ham.ipynb +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/docs/how-to-guides/simulate-vqe.ipynb +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/docs/tutorials/index.md +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/__init__.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/_cistring.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/_slow/__init__.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/_slow/contract/__init__.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/_slow/contract/diag_coulomb.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/_slow/contract/num_op_sum.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/_slow/fermion_operator.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/_slow/gates/__init__.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/_slow/gates/diag_coulomb.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/_slow/gates/num_op_sum.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/_slow/gates/orbital_rotation.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/contract/__init__.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/contract/diag_coulomb.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/contract/num_op_sum.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/contract/one_body.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/contract/two_body.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/gates/__init__.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/gates/basic_gates.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/gates/diag_coulomb.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/gates/num_op_sum.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/gates/orbital_rotation.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/gates/quad_ham.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/hamiltonians/__init__.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/hamiltonians/diagonal_coulomb_hamiltonian.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/hamiltonians/double_factorized_hamiltonian.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/hamiltonians/molecular_hamiltonian.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/hamiltonians/single_factorized_hamiltonian.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/init_cache.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/linalg/__init__.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/linalg/double_factorized_decomposition.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/linalg/linalg.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/linalg/predicates.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/linalg/util.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/molecular_data.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/operators/__init__.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/operators/common_operators.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/operators/fermi_hubbard.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/operators/fermion_action.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/operators/fermion_operator.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/optimize/__init__.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/optimize/_util.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/optimize/linear_method.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/protocols/__init__.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/protocols/apply_unitary_protocol.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/protocols/approximate_equality_protocol.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/protocols/diagonal_protocol.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/protocols/fermion_operator_protocol.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/protocols/linear_operator_protocol.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/protocols/trace_protocol.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/py.typed +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/qiskit/gates/__init__.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/qiskit/gates/diag_coulomb.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/qiskit/gates/diag_coulomb_trotter_split_op.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/qiskit/gates/double_factorized_trotter.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/qiskit/gates/givens_ansatz.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/qiskit/gates/num_num_ansatz.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/qiskit/gates/num_op_sum.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/qiskit/gates/orbital_rotation.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/qiskit/gates/slater_determinant.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/qiskit/gates/ucj.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/qiskit/jordan_wigner.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/qiskit/sampler.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/qiskit/sim.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/qiskit/transpiler_passes/drop_negligible.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/qiskit/transpiler_passes/merge_orbital_rotations.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/qiskit/transpiler_stages.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/qiskit/util.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/random/__init__.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/random/random.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/states/__init__.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/states/bitstring.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/states/dimensions.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/states/product_state_sum.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/states/rdm.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/states/sample_slater.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/states/spin.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/states/states.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/states/wick.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/testing/__init__.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/testing/testing.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/trotter/__init__.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/trotter/_util.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/trotter/diagonal_coulomb_split_op.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/trotter/double_factorized.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/trotter/qdrift.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/variational/__init__.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/variational/givens.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/variational/hopgate.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/variational/multireference.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/variational/num_num.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/variational/orbital_optimization.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/variational/uccsd.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/variational/ucj_angles_spin_balanced.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/variational/ucj_spin_balanced.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/variational/ucj_spin_unbalanced.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/variational/ucj_spinless.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/python/ffsim/variational/util.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/src/contract/diag_coulomb.rs +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/src/contract/mod.rs +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/src/contract/num_op_sum.rs +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/src/fermion_operator.rs +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/src/gates/diag_coulomb.rs +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/src/gates/mod.rs +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/src/gates/num_op_sum.rs +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/src/lib.rs +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/src/linalg/mod.rs +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/__init__.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/_slow/__init__.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/_slow/contract/__init__.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/_slow/contract/diag_coulomb_test.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/_slow/contract/num_op_sum_test.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/_slow/gates/__init__.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/_slow/gates/diag_coulomb_test.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/_slow/gates/num_op_sum_test.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/_slow/gates/orbital_rotation_test.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/contract/__init__.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/contract/diag_coulomb_test.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/contract/num_op_sum_test.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/contract/two_body_test.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/gates/__init__.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/gates/basic_gates_test.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/gates/diag_coulomb_test.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/gates/num_op_sum_test.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/gates/orbital_rotation_test.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/gates/quad_ham_test.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/hamiltonians/__init__.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/hamiltonians/diagonal_coulomb_hamiltonian_test.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/hamiltonians/double_factorized_hamiltonian_test.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/hamiltonians/molecular_hamiltonian_test.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/hamiltonians/single_factorized_hamiltonian_test.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/linalg/__init__.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/linalg/double_factorized_decomposition_test.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/linalg/givens_test.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/linalg/linalg_test.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/linalg/util_test.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/molecular_data_test.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/operators/__init__.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/operators/common_operators_test.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/operators/coupled_cluster_test.py +0 -0
- {ffsim-0.0.74 → ffsim-0.0.76}/tests/python/operators/fermi_hubbard_test.py +0 -0
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@@ -10,8 +10,6 @@ name = "ffsim"
|
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10
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crate-type = ["cdylib"]
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[dependencies]
|
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-
blas = "0.23"
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-
blas-src = "0.14"
|
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ndarray = { version = "0.15", features = ["rayon"] }
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num-integer = "0.1"
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numpy = "0.27"
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|
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|
"abi3-py310",
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22
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|
] }
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|
rayon = "1.11"
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-
|
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|
-
[target.'cfg(target_os = "linux")'.dependencies]
|
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blas-src = { version = "0.14", features = ["openblas"] }
|
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openblas-src = { version = "0.10", features = ["system"] }
|
|
@@ -1,6 +1,6 @@
|
|
|
1
1
|
Metadata-Version: 2.4
|
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2
|
Name: ffsim
|
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-
Version: 0.0.
|
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|
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Version: 0.0.76
|
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Classifier: License :: OSI Approved :: Apache Software License
|
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Classifier: Programming Language :: Python
|
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Classifier: Programming Language :: Python :: 3 :: Only
|
|
@@ -69,6 +69,22 @@ This method won't work natively on Windows, however. Refer to the [installation
|
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<!-- end installation -->
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|
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<!-- start get-started -->
|
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|
|
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|
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Visit [*State vectors and gates*](https://qiskit-community.github.io/ffsim/explanations/state-vectors-and-gates.html) to start learning ffsim's core concepts, or jump straight into a [tutorial](https://qiskit-community.github.io/ffsim/tutorials/double-factorized-trotter.html). Check out the [guides](https://qiskit-community.github.io/ffsim/how-to-guides/index.html) for help with specific tasks, or visit the [API reference](https://qiskit-community.github.io/ffsim/api/index.html) for detailed documentation of all function and classes available in the library.
|
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|
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<!-- end get-started -->
|
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|
|
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|
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<!-- start multithreading -->
|
|
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|
|
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|
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Some ffsim functions implemented in Rust use multithreading. The number of threads can be controlled using the environment variable `RAYON_NUM_THREADS`. For example, to disable multithreading, set this variable as `RAYON_NUM_THREADS=1`.
|
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<!-- end multithreading -->
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|
## Code example
|
|
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|
|
|
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|
<!-- start code-example -->
|
|
@@ -104,10 +120,6 @@ print(energy) # prints -104.17181289596
|
|
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104
120
|
|
|
105
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|
<!-- end code-example -->
|
|
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-
## Multithreading
|
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-
Some ffsim functions implemented in Rust use multithreading. The number of threads can be set using the environment variable `RAYON_NUM_THREADS`. For example, to disable multithreading, set this variable as `RAYON_NUM_THREADS=1`.
|
|
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|
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|
|
111
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|
## Citing ffsim
|
|
112
124
|
|
|
113
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|
<!-- start citing -->
|
|
@@ -24,6 +24,22 @@ This method won't work natively on Windows, however. Refer to the [installation
|
|
|
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24
|
|
|
25
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|
<!-- end installation -->
|
|
26
26
|
|
|
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|
+
## Get started
|
|
28
|
+
|
|
29
|
+
<!-- start get-started -->
|
|
30
|
+
|
|
31
|
+
Visit [*State vectors and gates*](https://qiskit-community.github.io/ffsim/explanations/state-vectors-and-gates.html) to start learning ffsim's core concepts, or jump straight into a [tutorial](https://qiskit-community.github.io/ffsim/tutorials/double-factorized-trotter.html). Check out the [guides](https://qiskit-community.github.io/ffsim/how-to-guides/index.html) for help with specific tasks, or visit the [API reference](https://qiskit-community.github.io/ffsim/api/index.html) for detailed documentation of all function and classes available in the library.
|
|
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|
+
|
|
33
|
+
<!-- end get-started -->
|
|
34
|
+
|
|
35
|
+
## Multithreading
|
|
36
|
+
|
|
37
|
+
<!-- start multithreading -->
|
|
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|
+
|
|
39
|
+
Some ffsim functions implemented in Rust use multithreading. The number of threads can be controlled using the environment variable `RAYON_NUM_THREADS`. For example, to disable multithreading, set this variable as `RAYON_NUM_THREADS=1`.
|
|
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|
+
|
|
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|
+
<!-- end multithreading -->
|
|
42
|
+
|
|
27
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|
## Code example
|
|
28
44
|
|
|
29
45
|
<!-- start code-example -->
|
|
@@ -59,10 +75,6 @@ print(energy) # prints -104.17181289596
|
|
|
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|
|
|
60
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|
<!-- end code-example -->
|
|
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77
|
|
|
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|
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## Multithreading
|
|
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|
-
|
|
64
|
-
Some ffsim functions implemented in Rust use multithreading. The number of threads can be set using the environment variable `RAYON_NUM_THREADS`. For example, to disable multithreading, set this variable as `RAYON_NUM_THREADS=1`.
|
|
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|
-
|
|
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|
## Citing ffsim
|
|
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|
|
|
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|
<!-- start citing -->
|
|
@@ -0,0 +1 @@
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<svg xmlns="http://www.w3.org/2000/svg" viewBox="0 0 72 72"><circle cx="36" cy="36" r="36" style="fill:#111"/><path d="M34.001 30.005c-.355 0-.508 0-.508-.254 0-.152.051-.305.102-.61 1.016-4.42 2.134-7.112 4.674-7.112.406 0 .812.102.812.407s-.254.254-.812.508c-.66.305-1.067 1.016-1.067 1.93 0 1.423 1.016 2.134 2.286 2.134 1.32 0 2.49-.864 2.49-2.743s-1.169-3.404-4.37-3.404c-4.927 0-7.67 3.505-9.347 8.382-.254.762-.305.762-1.016.762l-2.947.001c-.56 0-.813.254-.813.813q0 .762.762.762h2.946c.305 0 .407 0 .407.203 0 .102-.05.254-.102.508l-3.2 11.124c-1.423 4.98-2.337 6.605-4.37 6.605-.66 0-.914-.204-.914-.458 0-.406.458-.152 1.22-.66a2.22 2.22 0 0 0 1.016-1.88c0-1.32-.915-2.083-2.286-2.083-1.524 0-2.642 1.22-2.642 2.795 0 2.234 1.676 3.403 3.81 3.403 3.86 0 6.248-2.59 9.042-8.33 1.474-3.1 2.591-6.25 3.81-10.568l.051-.05c0-.153.407-.61.66-.61h7.198c.305 0 .407.001.407.204 0 .102-.05.254-.102.508l-3.2 11.124c-1.423 4.98-2.337 6.605-4.37 6.605-.66 0-.914-.204-.914-.458 0-.406.458-.152 1.22-.66a2.22 2.22 0 0 0 1.016-1.88c0-1.32-.915-2.083-2.286-2.083-1.524 0-2.642 1.22-2.642 2.795 0 2.234 1.676 3.403 3.81 3.403 3.86 0 6.248-2.59 9.042-8.33 1.474-3.1 2.591-6.25 3.81-10.568l.051-.05c0-.153.407-.61.66-.61h3.303c.558 0 .812-.254.812-.813q0-.762-.762-.762h-3.047c-.355 0-.508 0-.508-.254 0-.152.051-.305.102-.61 1.016-4.42 2.134-7.112 4.674-7.112.406 0 .812.102.812.407s-.254.254-.812.508c-.66.305-1.067 1.016-1.067 1.93 0 1.423 1.016 2.134 2.286 2.134 1.32 0 2.49-.864 2.49-2.743s-1.169-3.404-4.37-3.404c-4.927 0-7.67 3.505-9.347 8.382-.254.762-.305.762-1.016.762z" style="fill:#aaa"/></svg>
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<svg xmlns="http://www.w3.org/2000/svg" viewBox="0 0 72 72"><circle cx="36" cy="36" r="36" style="fill:#fff"/><path d="M34.001 30.005c-.355 0-.508 0-.508-.254 0-.152.051-.305.102-.61 1.016-4.42 2.134-7.112 4.674-7.112.406 0 .812.102.812.407s-.254.254-.812.508c-.66.305-1.067 1.016-1.067 1.93 0 1.423 1.016 2.134 2.286 2.134 1.32 0 2.49-.864 2.49-2.743s-1.169-3.404-4.37-3.404c-4.927 0-7.67 3.505-9.347 8.382-.254.762-.305.762-1.016.762l-2.947.001c-.56 0-.813.254-.813.813q0 .762.762.762h2.946c.305 0 .407 0 .407.203 0 .102-.05.254-.102.508l-3.2 11.124c-1.423 4.98-2.337 6.605-4.37 6.605-.66 0-.914-.204-.914-.458 0-.406.458-.152 1.22-.66a2.22 2.22 0 0 0 1.016-1.88c0-1.32-.915-2.083-2.286-2.083-1.524 0-2.642 1.22-2.642 2.795 0 2.234 1.676 3.403 3.81 3.403 3.86 0 6.248-2.59 9.042-8.33 1.474-3.1 2.591-6.25 3.81-10.568l.051-.05c0-.153.407-.61.66-.61h7.198c.305 0 .407.001.407.204 0 .102-.05.254-.102.508l-3.2 11.124c-1.423 4.98-2.337 6.605-4.37 6.605-.66 0-.914-.204-.914-.458 0-.406.458-.152 1.22-.66a2.22 2.22 0 0 0 1.016-1.88c0-1.32-.915-2.083-2.286-2.083-1.524 0-2.642 1.22-2.642 2.795 0 2.234 1.676 3.403 3.81 3.403 3.86 0 6.248-2.59 9.042-8.33 1.474-3.1 2.591-6.25 3.81-10.568l.051-.05c0-.153.407-.61.66-.61h3.303c.558 0 .812-.254.812-.813q0-.762-.762-.762h-3.047c-.355 0-.508 0-.508-.254 0-.152.051-.305.102-.61 1.016-4.42 2.134-7.112 4.674-7.112.406 0 .812.102.812.407s-.254.254-.812.508c-.66.305-1.067 1.016-1.067 1.93 0 1.423 1.016 2.134 2.286 2.134 1.32 0 2.49-.864 2.49-2.743s-1.169-3.404-4.37-3.404c-4.927 0-7.67 3.505-9.347 8.382-.254.762-.305.762-1.016.762z" style="fill:#000"/></svg>
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# HTML static files
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# autosummary options
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114
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"source": [
|
|
115
115
|
"n_reps = 2\n",
|
|
116
116
|
"\n",
|
|
117
|
-
"# Construct from random t2- and t1-amplitudes. The t2-amplitudes are double
|
|
117
|
+
"# Construct from random t2- and t1-amplitudes. The t2-amplitudes are double-factorized\n",
|
|
118
118
|
"# to obtain the diagonal Coulomb matries and orbital rotations. The t1-amplitudes are\n",
|
|
119
119
|
"# used to set a final orbital rotation.\n",
|
|
120
120
|
"t2 = ffsim.random.random_t2_amplitudes(norb, nocc, seed=rng, dtype=float)\n",
|