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Partial charge

Known as: Partial, Partial atomic charge, Partial charges 
A partial charge is a non-integer charge value when measured in elementary charge units. Partial charge is more commonly called net atomic charge. It… 
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Papers overview

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2007
2007
We show how to derive Catterall's supersymmetric lattice gauge theories directly from the general principle of orbifolding… 
2007
2007
A computational (ZINDO) investigation is employed to estimate the molecular hyperpolarizability (β) of a [(TTF−NH2)8] (TTF… 
2004
2004
The NMR spin−spin coupling constants (SSCCs) across the H-bond in proteins are sensitive to the electronic structure of the H… 
1998
1998
Haloalkane dehalogenase is a bacterial enzyme, which catalyzes hydrolytic cleavage of the carbon−halogen bond of haloalkanes… 
1994
1994
Starting from the bond polarization theory (BPT), a new semiempirical method for the calculation of net atomic charges is… 
Highly Cited
1994
Highly Cited
1994
Traditional net atomic charge models were found unsatisfactory for representing the molecular electric potential (MEP) of n… 
Highly Cited
1990
Highly Cited
1990
Previous work has shown that the simple point‐charge (SPC) model can represent the experimental dielectric constant of water. In…