Spin-Coupled Generalized Valence Bond Theory: New Perspectives on the Electronic Structure of Molecules and Chemical Bonds

2021 ◽  
Vol 125 (10) ◽  
pp. 2021-2050
Author(s):  
Thom H. Dunning ◽  
Lu T. Xu ◽  
David L. Cooper ◽  
Peter B. Karadakov
Keyword(s):  
Electronic Structure ◽  
Valence Bond ◽  
Chemical Bonds ◽  
Valence Bond Theory ◽  
Generalized Valence Bond ◽  
Structure Of Molecules ◽  
Bond Theory ◽  
Generalized Valence Bond Theory

scholarly journals Insights into the Electronic Structure of Molecules from Generalized Valence Bond Theory

2016 ◽  
Vol 120 (11) ◽  
pp. 1763-1778 ◽  
Author(s):  
Thom H. Dunning ◽  
Lu T. Xu ◽  
Tyler Y. Takeshita ◽  
Beth A. Lindquist
Keyword(s):  
Electronic Structure ◽  
Valence Bond ◽  
Valence Bond Theory ◽  
Generalized Valence Bond ◽  
Structure Of Molecules ◽  
Bond Theory ◽  
Generalized Valence Bond Theory

Insights into the Electronic Structure of Disulfur Tetrafluoride Isomers from Generalized Valence Bond Theory

2014 ◽  
Vol 118 (43) ◽  
pp. 10117-10126 ◽  
Author(s):  
Beth A. Lindquist ◽  
Alaina L. Engdahl ◽  
David E. Woon ◽  
Thom H. Dunning
Keyword(s):  
Electronic Structure ◽  
Valence Bond ◽  
Valence Bond Theory ◽  
Generalized Valence Bond ◽  
Bond Theory ◽  
Generalized Valence Bond Theory

Rule-Based Trial Wave Functions for Generalized Valence Bond Theory

1994 ◽  
Vol 98 (51) ◽  
pp. 13498-13505 ◽  
Author(s):  
Jean-Marc Langlois ◽  
Terumasa Yamasaki ◽  
Richard P. Muller ◽  
William A. III Goddard
Keyword(s):  
Valence Bond ◽  
Wave Functions ◽  
Rule Based ◽  
Valence Bond Theory ◽  
Generalized Valence Bond ◽  
Bond Theory ◽  
Generalized Valence Bond Theory
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