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Fionn Malone 6bcc3a0c6b Unit test for PHMSD molecular calculation. 2019-07-23 11:29:22 -07:00
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README Unit test for PHMSD molecular calculation. 2019-07-23 11:29:22 -07:00
scf.py Unit test for PHMSD molecular calculation. 2019-07-23 11:29:22 -07:00

README 

scf.py will generate the hamiltonian and particle-hole multi slater
determinant expansion.