Many-Body Expansion with Overlapping Fragments: Analysis of Two Approaches.
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Molecular energies from an incremental fragmentation method.On the Stability of Cyclophane Derivates Using a Molecular Fragmentation Method.Approaching the complete-basis limit with a truncated many-body expansion.Understanding the many-body expansion for large systems. III. Critical role of four-body terms, counterpoise corrections, and cutoffs.Accuracy of finite-difference harmonic frequencies in density functional theory.Understanding the many-body expansion for large systems. I. Precision considerations.The many-body expansion combined with neural networks.Are fragment-based quantum chemistry methods applicable to medium-sized water clusters?Fragment quantum chemical approach to geometry optimization and vibrational spectrum calculation of proteins.
P2860
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P2860
Many-Body Expansion with Overlapping Fragments: Analysis of Two Approaches.
description
2013 nî lūn-bûn
@nan
2013年の論文
@ja
2013年論文
@yue
2013年論文
@zh-hant
2013年論文
@zh-hk
2013年論文
@zh-mo
2013年論文
@zh-tw
2013年论文
@wuu
2013年论文
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2013年论文
@zh-cn
name
Many-Body Expansion with Overlapping Fragments: Analysis of Two Approaches.
@en
type
label
Many-Body Expansion with Overlapping Fragments: Analysis of Two Approaches.
@en
prefLabel
Many-Body Expansion with Overlapping Fragments: Analysis of Two Approaches.
@en
P356
P1476
Many-Body Expansion with Overlapping Fragments: Analysis of Two Approaches
@en
P2093
Ryan M Richard
P304
P356
10.1021/CT300985H
P577
2013-02-21T00:00:00Z