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Make scc a module
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fevangelista committed Nov 1, 2024
1 parent 3a68f0f commit ed0d7f2
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Showing 6 changed files with 9 additions and 508 deletions.
1 change: 1 addition & 0 deletions forte/modules/__init__.py
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Expand Up @@ -9,6 +9,7 @@
from .options_factory import OptionsFactory
from .objects_factory_fcidump import ObjectsFromFCIDUMP
from .objects_factory_psi4 import ObjectsFromPsi4
from .general_cc import GeneralCC

try:
from .objects_factory_pyscf import ObjectsFromPySCF
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2 changes: 1 addition & 1 deletion forte/modules/module.py
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Expand Up @@ -22,7 +22,7 @@ def __init__(
options: dict
A dictionary of options. Defaults to None.
"""
self._options = options
self._options = options or {}
self._executed = False

@property
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1 change: 1 addition & 0 deletions forte/modules/validators.py
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Expand Up @@ -16,6 +16,7 @@ class Feature(Enum):
MO_SPACE_INFO = "mo_space_info"
INTS = "ints"
RESULTS = "results"
AS_INTS = "as_ints"
# options = auto()
# state_weights_map = auto()
# symmetry = auto()
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