Local Hbar #60
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Local Hbar #60
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added 7 commits
February 7, 2023 06:26
lothian
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Apr 3, 2023
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| from .utils import helper_diis, cc_contract | ||
| from .hamiltonian import Hamiltonian | ||
| from .local import Local | ||
| from .cctriples import t_tjl, t3c_ijk | ||
| from .lccwfn import lccwfn | ||
| from utils import helper_diis, cc_contract #helper_ldiis | ||
| from hamiltonian import Hamiltonian | ||
| from local import Local | ||
| from cctriples import t_tjl, t3c_ijk | ||
| from lccwfn import lccwfn | ||
| from debug import Debug |
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Can you help me to understand what's happening here? Are you temporarily changing the interface to run the code directly?
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Description
Adding local representation of Hbar to cchbar object that will be subsequently used for the lambda expressions
Todos
Notable points that this PR has either accomplished or will accomplish.
Notes
The local Hbar is tested against the simulation code. Further test can be made once the local lambda expressions are implemented.
Status