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Cleanup string import #5

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Merged
LinusBDittmer merged 5 commits into from
Jun 9, 2025
Merged

Cleanup string import #5

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c77a20a
update split_idx_string using regular expressions
jonasleitner Jun 5, 2025
17c34bf
refactor import_from_sympy_latex
jonasleitner Jun 5, 2025
211d09e
add callables to identify amplitudes and symmetrictensors during import
jonasleitner Jun 6, 2025
914462c
fix bug in spin detection in coulomb expansion and add ri unit tests
jonasleitner Jun 7, 2025
0814293
add float import
jonasleitner Jun 9, 2025
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4 changes: 2 additions & 2 deletions adcgen/__init__.py
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Original file line number Diff line number Diff line change
@@ -1,9 +1,9 @@
from .core_valence_separation import apply_cvs_approximation
from .derivative import derivative
from .eri_orbenergy import EriOrbenergy
from .expression import ExprContainer
from .expression import ExprContainer, import_from_sympy_latex
from .factor_intermediates import factor_intermediates
from .func import import_from_sympy_latex, evaluate_deltas, wicks
from .func import evaluate_deltas, wicks
from .generate_code import (generate_code, optimize_contractions, Contraction,
unoptimized_contraction)
from .groundstate import GroundState
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4 changes: 3 additions & 1 deletion adcgen/expression/__init__.py
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Original file line number Diff line number Diff line change
@@ -1,4 +1,5 @@
from .expr_container import ExprContainer
from .import_from_sympy_latex import import_from_sympy_latex
from .normal_ordered_container import NormalOrderedContainer
from .object_container import ObjectContainer
from .polynom_container import PolynomContainer
Expand All @@ -8,5 +9,6 @@
__all__ = [
"ExprContainer", "NormalOrderedContainer",
"PolynomContainer",
"ObjectContainer", "TermContainer"
"ObjectContainer", "TermContainer",
"import_from_sympy_latex"
]
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