scholarly journals Incremental evaluation of coupled cluster dipole polarizabilities

2015 ◽  
Vol 17 (22) ◽  
pp. 14284-14296 ◽  
Author(s):  
Joachim Friedrich ◽  
Harley R. McAlexander ◽  
Ashutosh Kumar ◽  
T. Daniel Crawford
Keyword(s):  
Linear Response ◽  
Coupled Cluster ◽  
Response Frequency ◽  
Frequency Dependent ◽  
Incremental Evaluation ◽  
Incremental Scheme ◽  
Dipole Polarizabilities

In this work we present the first implementation of the incremental scheme for coupled cluster linear-response frequency-dependent dipole polarizabilities.

Static and Frequency-Dependent Dipole–Dipole Polarizabilities of All Closed-Shell Atoms up to Radium: A Four-Component Relativistic DFT Study

ChemPhysChem ◽  
2008 ◽  
Vol 9 (3) ◽  
pp. 445-453 ◽  
Author(s):  
Radovan Bast ◽  
Andreas Heßelmann ◽  
Paweł Sałek ◽  
Trygve Helgaker ◽  
Trond Saue
Keyword(s):  
Closed Shell ◽  
Dft Study ◽  
Frequency Dependent ◽  
Relativistic Dft ◽  
Dipole Polarizabilities

Frequency-dependent linear response of superconducting systems

1995 ◽  
Vol 56 (5) ◽  
pp. 521-533 ◽  
Author(s):  
Martin Lüders ◽  
E. K. U. Gross
Keyword(s):  
Linear Response ◽  
Frequency Dependent

Calculation of frequency-dependent hyperpolarizabilities using general coupled-cluster models

2007 ◽  
Vol 127 (13) ◽  
pp. 134109 ◽  
Author(s):  
Darragh P. O’Neill ◽  
Mihály Kállay ◽  
Jürgen Gauss
Keyword(s):  
Cluster Models ◽  
Coupled Cluster ◽  
Frequency Dependent
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