How many bound valence states does the C60− anion have?

2016 ◽  
Vol 18 (16) ◽  
pp. 10840-10845 ◽  
Author(s):  
Evgeniy V. Gromov ◽  
Shachar Klaiman ◽  
Lorenz S. Cederbaum
Keyword(s):  
Coupled Cluster ◽  
Heuristic Model ◽  
Cluster Calculations ◽  
Valence States ◽  
Coupled Cluster Calculations

We report on unprecedentedly large coupled cluster calculations for the C60− anion, and on a heuristic model uncovering the valence states of C60− that allow the resolution of the headlined question.

scholarly journals Accelerating coupled cluster calculations with nonlinear dynamics and supervised machine learning

2021 ◽  
Vol 154 (4) ◽  
pp. 044110
Author(s):  
Valay Agarawal ◽  
Samrendra Roy ◽  
Anish Chakraborty ◽  
Rahul Maitra
Keyword(s):  
Nonlinear Dynamics ◽  
Machine Learning ◽  
Supervised Machine Learning ◽  
Coupled Cluster ◽  
Cluster Calculations ◽  
Coupled Cluster Calculations
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