Showing results 2 to 5 of 5
Density Functional and Spin-Orbit Ab Initio Study of CF3Br: Molecular Properties and Electronic Curve Crossing Kim, Joonghan; Kim, Tae Kyu; Ihee, Hyotcherl, JOURNAL OF PHYSICAL CHEMISTRY A, v.115, no.7, pp.1264 - 1271, 2011-02 |
Density Functional Theory Assessment of Molecular Structures and Energies of Neutral and Anionic Aln (n=2-10) Clusters Paranthaman, Selvarengan; Hong, Kiryong; Kim, Joonghan; Kim, Dong Eon; Kim, Tae Kyu, JOURNAL OF PHYSICAL CHEMISTRY A, v.117, no.38, pp.9293 - 9303, 2013-09 |
Prediction of transition state barriers and enthalpies of reaction by a new hybrid density-functional approximation Kang, Jeung Ku; Musgrave CB, JOURNAL OF CHEMICAL PHYSICS, v.115, no.24, pp.11040 - 11051, 2001-12 |
Structures and N -> Si bond characters of 1-fluorosilatrane and the silatranyl cation Lee, HS; Bae, C; Do, Youngkyu; Lee, Yoon Sup, BULLETIN OF THE KOREAN CHEMICAL SOCIETY, v.23, no.2, pp.215 - 220, 2002-02 |
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