Results 221 to 226 of about 23,057 (226)

Impact of Local Approximations on MP2 Vibrational Frequencies

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy, 1999
Hans-Joachim Werner, Guntram Rauhut, Frank Eckert   +2 more
exaly  

The Divide–Expand–Consolidate MP2 Scheme Goes Massively Parallel

Molecular Physics, 2013
Thomas Kjærgaard, Kasper Kristensen, Ida-Marie Høyvik   +2 more
exaly  

Assessment of Ab Initio MP2 and Density Functionals for Characterizing the Potential Energy Profiles of the SN2 Reactions at N Center

Journal of Computational Chemistry, 2012
Feng Yu
exaly  

= 1.2 mg mP2S -'; = 0.4;

2001
openaire   +1 more source

B-coloring of MP2-graphs

Applied Mathematics and Computation
Dong Chen, Weifan Wang, Yitong Xu
openaire   +1 more source

Mobile and personal projection (MP2)

2011
openaire   +1 more source