scholarly journals CONNECTED TRIPLE EXCITATIONS IN THE EQUATION-OF-MOTION COUPLED CLUSTER CALCULATIONS OF THE ENERGIES AND PROPERTIES OF EXCITED STATES: HCN MOLECULE*

2003 ◽  
Vol 9 (1) ◽  
pp. 163-172 ◽  
Author(s):  
MARTA WLOCH ◽  
MONIKA MUSIAL
Keyword(s):  
Excited States ◽  
Equation Of Motion ◽  
Coupled Cluster ◽  
Cluster Calculations ◽  
Coupled Cluster Calculations

scholarly journals Bound and continuum-embedded states of cyanopolyyne anions

2018 ◽  
Vol 20 (7) ◽  
pp. 4805-4817 ◽  
Author(s):  
Wojciech Skomorowski ◽  
Sahil Gulania ◽  
Anna I. Krylov
Keyword(s):  
Excited States ◽  
Equation Of Motion ◽  
Coupled Cluster ◽  
Cluster Calculations ◽  
Coupled Cluster Calculations

Equation-of-motion coupled-cluster calculations reveal systematic trends across bound and continuum-embedded excited states in cyanopolyyne anions.

scholarly journals Coupled Cluster Calculations of Ground and Excited States of Nuclei

2004 ◽  
Vol 92 (13) ◽  
Author(s):  
K. Kowalski ◽  
D. J. Dean ◽  
M. Hjorth-Jensen ◽  
T. Papenbrock ◽  
P. Piecuch
Keyword(s):  
Excited States ◽  
Coupled Cluster ◽  
Cluster Calculations ◽  
Coupled Cluster Calculations

scholarly journals Towards a rational design of laser-coolable molecules: insights from equation-of-motion coupled-cluster calculations

2019 ◽  
Vol 21 (35) ◽  
pp. 19447-19457 ◽  
Author(s):  
Maxim V. Ivanov ◽  
Felix H. Bangerter ◽  
Anna I. Krylov
Keyword(s):  
Rational Design ◽  
Information Science ◽  
Equation Of Motion ◽  
Coupled Cluster ◽  
Quantum Information Science ◽  
Cold Molecules ◽  
Cluster Calculations ◽  
New Sensors ◽  
New Phenomena ◽  
Coupled Cluster Calculations

Access to cold molecules is critical for quantum information science, design of new sensors, ultracold chemistry, and search of new phenomena.

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