openqemist.tests.electronic_structure_solvers.fci_solver package

Submodules

openqemist.tests.electronic_structure_solvers.fci_solver.test_fci_solver module

class openqemist.tests.electronic_structure_solvers.fci_solver.test_fci_solver.FCISolverTest(methodName='runTest')

Bases: unittest.case.TestCase

test_be_no_mf()

Test the FCISolver against result from reference implementation with mean field not calculated.

test_be_with_mf()

Test the FCISolver against result from reference implementation with mean field calculated and passed in.

test_get_rdm_without_simulate()

Test that the runtime error is raised when user calls get RDM without first running a simulation.

test_h2_no_mf()

Test the FCISolver against result from reference implementation with mean field not calculated.

test_h2_with_mf()

Test the FCISolver against result from reference implementation with mean field calculated and passed in.

Module contents