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The Journal of Physical Chemistry. A|July 31, 2010
Infrared spectra and intensities of Ar-H(2)O and O(2)-H(2)O complexes in the range of the nu(3) band of H(2)OSusumu Kuma, Mikhail N Slipchenko, Takamasa Momose, et al.The Journal of Physical Chemistry. A|July 31, 2010
Low-lying structures and stabilities of large water clusters: investigation based on the combination of the AMOEBA potential and generalized energy-based fragmentation approachZhen Yang, Shugui Hua, Weijie Hua, et al.The Journal of Physical Chemistry. A|July 31, 2010
Atmospheric oxidation of tetrachloroethylene: an ab initio studyCarrie J Christiansen, Joseph S FranciscoThe Journal of Physical Chemistry. A|August 6, 2010
Origin of rare and highly efficient phosphorescent and electroluminescent iridium(III) complexes based on C--N=N ligands, a theoretical explanationXiao-Na Li, Zhi-Jian Wu, Xiao-Juan Liu, et al.The Journal of Physical Chemistry. A|August 6, 2010
Conformational analysis of 2,2'-bithiophene revisited: the maximum entropy method applied to large sets of H-H and 13C-H partially averaged dipolar couplingsGiorgio CinacchiThe Journal of Physical Chemistry. A|August 6, 2010
Ping-pong at gold: proton jump between coordinated phenyl and eta1-benzene ligands, a computational studyManik Kumer Ghosh, Mats Tilset, Ajay Venugopal, et al.The Journal of Physical Chemistry. A|August 6, 2010
Anticooperative effect induced by mixed solvation in H+ (CH3OH)m(H2O)n (m + n = 5 and 6): a theoretical and infrared spectroscopic studyDan Bing, Toru Hamashima, Asuka Fujii, et al.The Journal of Physical Chemistry. A|August 6, 2010
First-principles calculation of electron spin-rotation tensorsGyörgy Tarczay, Péter G Szalay, Jürgen GaussThe Journal of Physical Chemistry. A|August 11, 2010
Theoretical prediction of stable noble-gas anions XeNO(2)(-) and XeNO(3)(-) with very short xenon-nitrogen bond lengthsYi-Lun Sun, Jie-Ting Hong, Wei-Ping HuThe Journal of Physical Chemistry. A|August 7, 2010
Nature and strength of M-S bonds (m = Au, Ag, and Cu) in binary alloy gold clustersA H Pakiari, Z JamshidiPageof 2,777