Explicitly-correlated double ionization potentials and double electron attachment equation-of-motion coupled cluster methods

2018 ◽  
Vol 692 ◽  
pp. 191-195 ◽  
Author(s):  
Denis Bokhan ◽  
Dmitrii N. Trubnikov ◽  
Ajith Perera ◽  
Rodney J. Bartlett
Keyword(s):  
Electron Attachment ◽  
Equation Of Motion ◽  
Double Ionization ◽  
Ionization Potentials ◽  
Coupled Cluster ◽  
Coupled Cluster Methods ◽  
Double Electron ◽  
Explicitly Correlated ◽  
Cluster Methods

scholarly journals Equation of motion coupled cluster methods for electron attachment and ionization potential in polyacenes

2015 ◽  
Vol 641 ◽  
pp. 146-152 ◽  
Author(s):  
Kiran Bhaskaran-Nair ◽  
Karol Kowalski ◽  
Mark Jarrell ◽  
Juana Moreno ◽  
William A. Shelton
Keyword(s):  
Ionization Potential ◽  
Electron Attachment ◽  
Equation Of Motion ◽  
Coupled Cluster ◽  
Coupled Cluster Methods ◽  
Cluster Methods

Equation of motion coupled cluster methods for electron attachment and ionization potential in fullerenes C60and C70

2014 ◽  
Vol 141 (7) ◽  
pp. 074304 ◽  
Author(s):  
Kiran Bhaskaran-Nair ◽  
Karol Kowalski ◽  
Juana Moreno ◽  
Mark Jarrell ◽  
William A. Shelton
Keyword(s):  
Ionization Potential ◽  
Electron Attachment ◽  
Equation Of Motion ◽  
Coupled Cluster ◽  
Coupled Cluster Methods ◽  
Cluster Methods
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