scholarly journals libecpint: A C++ library for the efficient evaluation of integrals over effective core potentials

2021 ◽  
Vol 6 (60) ◽  
pp. 3039
Author(s):  
Robert Shaw ◽  
J. Hill
Keyword(s):  
Effective Core Potentials

scholarly journals A new generation of effective core potentials from correlated calculations: 3d transition metal series

2018 ◽  
Vol 149 (13) ◽  
pp. 134108 ◽  
Author(s):  
Abdulgani Annaberdiyev ◽  
Guangming Wang ◽  
Cody A. Melton ◽  
M. Chandler Bennett ◽  
Luke Shulenburger ◽  
...  
Keyword(s):  
Transition Metal ◽  
New Generation ◽  
Effective Core Potentials

Analytical second derivatives for effective core potentials

1988 ◽  
Vol 153 (1) ◽  
pp. 76-81 ◽  
Author(s):  
Jürgen Breidung ◽  
Walter Thiel ◽  
Andrew Komornicki
Keyword(s):  
Second Derivatives ◽  
Effective Core Potentials

scholarly journals Combining Slater-type orbitals and effective core potentials

2017 ◽  
Vol 95 (5) ◽  
Author(s):  
Michał Lesiuk ◽  
Aleksandra M. Tucholska ◽  
Robert Moszynski
Keyword(s):  
Slater Type Orbitals ◽  
Slater Type ◽  
Effective Core Potentials
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