Browse "CH-Journal Papers(저널논문)" by Subject THERMOCHEMISTRY
Showing results 1 to 12 of 12
| Basis set effects on the stability of the Cl2O3 isomers using B3P86 and B3LYP methods of density functional theory Kim, KH; Han, YK; Lee, Yoon Sup, JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, v.460, no.1-3, pp.19 - 25, 1999-02 |
| Comparing the Electronic Structure of Iron, Cobalt, and Nickel Compounds That Feature a Phosphine-Substituted Bis(imino)pyridine Chelate Mena, Matthew R.; Kim, Jun-Hyeong; So, Sangho; Ben-Daat, Hagit; Porter, Tyler M.; Ghosh, Chandrani; Sharma, Anuja; et al, INORGANIC CHEMISTRY, v.61, no.17, pp.6438 - 6450, 2022-05 |
| Disrotatory Ring-Opening of Furans Gives Stereocontrol Jeong, Jinhoon; Kim, Hyunjoong; Hazra, Chinmoy K.; Chang, Sukbok; Baik, Mu-Hyun, THE JOURNAL OF ORGANIC CHEMISTRY, v.84, no.17, pp.11061 - 11067, 2019-09 |
| First-order correction for bond energy applied to polar molecules: Alkali halides, alkali cyanides, LiCH(3), and CH(3)F Lee, Dong-ki; Lee, Yoon Sup; Hagebaum-Reignier, D.; Jeung, Gwang-Hi, CHEMICAL PHYSICS, v.327, no.2-3, pp.406 - 414, 2006-09 |
| Formation of the Charge-Localized Dimer Radical Cation o 2-Ethyl-9,10-dimethoxyanthracene in Solution Phase Choi, Jungkweon; Ahn, Doo-Sik; Fujitsuka, Mamoru; Tojo, Sachiko; Ihee, Hyotcherl; Majima, Tetsuro, CHEMISTRY-A EUROPEAN JOURNAL, v.25, no.21, pp.5586 - 5594, 2019-04 |
| Photodissociation reaction of 1,2-diiodoethane in solution: A theoretical and X-ray diffraction study Kong, Qingyu; Kim, Joonghan; Lorenc, M; Kim, Tae Kyu; Ihee, Hyotcherl; Wulff, M, JOURNAL OF PHYSICAL CHEMISTRY A, v.109, no.45, pp.10451 - 10458, 2005-11 |
| Pitfalls in Computational Modeling of Chemical Reactions and How To Avoid Them Ryu, Ho; Park, Jiyong; Kim, Hong Ki; Park, Ji Young; Kim, Seoung Tae; Baik, Mu-Hyun, ORGANOMETALLICS, v.37, no.19, pp.3228 - 3239, 2018-10 |
| Regioselective Oxidation of C-H Bonds in Unactivated Alkanes by a Vanadium Superoxo Catalyst Bound to a Supramolecular Host Sundararajan, Mahesh; Park, Bohyun; Baik, Mu-Hyun, INORGANIC CHEMISTRY, v.58, no.23, pp.16250 - 16255, 2019-12 |
| Selective ring expansion and C-H functionalization of azulenes Park, Sangjune; Kim, Cheol-Eui; Jeong, Jinhoon; Ryu, Ho; Maeng, Chanyoung; Kim, Dongwook; Baik, Mu-Hyun; et al, NATURE COMMUNICATIONS, v.14, no.1, 2023-12 |
Self-organization of silicates on different length scales exemplified by amorphous mesoporous silica and mesoporous zeolite beta using multiammonium surfactants Castro, Maria; Losch, Pit; Farès, Christophe; Haouas, Mohamed; Taulelle, Francis; Breynaert, Eric; Kirschhock, Christine; et al, RSC ADVANCES, v.10, no.35, pp.20928 - 20938, 2020-06 |
| Spin-Orbit and Electron Correlation Effects on the Structure of EF(3) (E = I, At, and Element 117) Kim, Hyoseok; Choi, Yoon Jeong; Lee, Yoon Sup, JOURNAL OF PHYSICAL CHEMISTRY B, v.112, no.50, pp.16021 - 16029, 2008-12 |
| Theoretical study of the extremely small torsional barriers of thiophenol in the ground and the first excited electronic states Choi, Heechol; Park, Young Choon; Lee, Yoon Sup; An, Heesun; Baeck, Kyoung Koo, CHEMICAL PHYSICS LETTERS, v.580, pp.32 - 36, 2013-08 |
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