GenLocDip: A Generalized Program to Calculate and Visualize Local Electric Dipole Moments.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 25, p. 2324, doi. 10.1002/jcc.24420
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- Publication type:
- Article
Works matching IS 01928651 AND DT 2016 AND VI 37 AND IP 25
Results: 7
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The Nature of Structure and Bonding between Transition Metal and Mixed Si-Ge Tetramers: A 20-Electron Superatom System.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 25, p. 2316, doi. 10.1002/jcc.24456
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- Publication type:
- Article
3
Informatics-Based Energy Fitting Scheme for Correlation Energy at Complete Basis Set Limit.
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- Journal of Computational Chemistry, 2016, v. 37, n. 25, p. 2304, doi. 10.1002/jcc.24455
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- Article
4
A Generalized Operational Formula Based on Total Electronic Densities to Obtain 3D Pictures of the Dual Descriptor to Reveal Nucleophilic and Electrophilic Sites Accurately on Closed-Shell Molecules.
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- Journal of Computational Chemistry, 2016, v. 37, n. 25, p. 2279, doi. 10.1002/jcc.24453
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- Article
5
Stability of Functionalized Corannulene Cations [R-C<sub>20</sub>H<sub>10</sub>]+: An Influence of the Nature of R-Group.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 25, p. 2266, doi. 10.1002/jcc.24444
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- Publication type:
- Article
6
Local Electric Dipole Moments: A Generalized Approach.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 25, p. 2260, doi. 10.1002/jcc.24440
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- Publication type:
- Article
7
Geometrical Control of the Interatomic Coulombic Decay Process in Quantum Dots for Infrared Photodetectors.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 25, p. 2249, doi. 10.1002/jcc.24410
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- Publication type:
- Article