An ab Initio Study of van der Waals Potential Energy Parameters for Silver Clusters

2011 ◽  
Vol 115 (11) ◽  
pp. 2332-2339 ◽  
Author(s):  
Vesa Hänninen ◽  
Markus Korpinen ◽  
Qinghua Ren ◽  
Robert Hinde ◽  
Lauri Halonen
Keyword(s):  
Potential Energy ◽  
Ab Initio ◽  
Van Der Waals ◽  
Silver Clusters ◽  
Ab Initio Study ◽  
Energy Parameters

Potential coupling of intramolecular to intermolecular modes: an ab initio study of the amino inversion and van der Waals motions in the aniline–argon complex

2001 ◽  
Vol 269 (1-3) ◽  
pp. 29-36 ◽  
Author(s):  
I López-Tocón ◽  
J.C Otero ◽  
M Becucci ◽  
G Pietraperzia ◽  
E Castellucci ◽  
...  
Keyword(s):  
Ab Initio ◽  
Van Der Waals ◽  
Ab Initio Study

Electron Affinity of Hydrogen Peroxide and the [H2,O2]•-Potential Energy Surface. A Comparative DFT and ab Initio Study

1996 ◽  
Vol 100 (1) ◽  
pp. 100-110 ◽  
Author(s):  
Jan Hrušák ◽  
Heike Friedrichs ◽  
Helmut Schwarz ◽  
Holy Razafinjanahary ◽  
Henry Chermette
Keyword(s):  
Hydrogen Peroxide ◽  
Potential Energy ◽  
Potential Energy Surface ◽  
Ab Initio ◽  
Electron Affinity ◽  
Energy Surface ◽  
Ab Initio Study

Ab initio study of Hg-Hg and E112-E112 van der Waals interactions

2009 ◽  
Vol 72 (3) ◽  
pp. 396-400 ◽  
Author(s):  
A. N. Petrov ◽  
N. S. Mosyagin ◽  
A. V. Titov ◽  
A. V. Zaitsevskii ◽  
E. A. Rykova
Keyword(s):  
Ab Initio ◽  
Van Der Waals ◽  
Van Der Waals Interactions ◽  
Ab Initio Study

An ab initio study of the potential energy surface of methylamine dimer

2002 ◽  
Vol 586 (1-3) ◽  
pp. 225-234 ◽  
Author(s):  
Enrique M Cabaleiro-Lago ◽  
Jesús Rodrı́guez-Otero
Keyword(s):  
Potential Energy ◽  
Potential Energy Surface ◽  
Ab Initio ◽  
Energy Surface ◽  
Ab Initio Study

scholarly journals From Two- to Three-Dimensional van der Waals Layered Structures of Boron Crystals: An Ab Initio Study

ACS Omega ◽  
2019 ◽  
Vol 4 (5) ◽  
pp. 8015-8021 ◽  
Author(s):  
Dengfeng Li ◽  
QiQi Tang ◽  
Jia He ◽  
Bolin Li ◽  
Guangqian Ding ◽  
...  
Keyword(s):  
Ab Initio ◽  
Van Der Waals ◽  
Three Dimensional ◽  
Layered Structures ◽  
Ab Initio Study
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