test_MO.cpp File Reference

Include dependency graph for test_MO.cpp:

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Namespaces
	qmcplusplus
	helper functions for EinsplineSetBuilder

Functions
void	test_He (bool transform)
	TEST_CASE ("ReadMolecularOrbital GTO He", "[wavefunction]")
	TEST_CASE ("ReadMolecularOrbital Numerical He", "[wavefunction]")
void	test_He_mw (bool transform)
	TEST_CASE ("mw_evaluate Numerical He", "[wavefunction]")
void	test_EtOH_mw (bool transform)
	TEST_CASE ("mw_evaluate Numerical EtOH", "[wavefunction]")
	TEST_CASE ("mw_evaluate GTO EtOH", "[wavefunction]")
void	test_Ne (bool transform)
	TEST_CASE ("ReadMolecularOrbital GTO Ne", "[wavefunction]")
	TEST_CASE ("ReadMolecularOrbital Numerical Ne", "[wavefunction]")
	TEST_CASE ("ReadMolecularOrbital HCN", "[wavefunction]")
void	test_HCN (bool transform)
	TEST_CASE ("ReadMolecularOrbital GTO HCN", "[wavefunction]")
	TEST_CASE ("ReadMolecularOrbital Numerical HCN", "[wavefunction]")