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Results: 1-9 |
Results: 9
Application of the multiensemble sampling to the hydration free energy
Authors: Han, KK Kim, KH Mhin, BJ Son, HS
Citation: Kk. Han et al., Application of the multiensemble sampling to the hydration free energy, J COMPUT CH, 22(10), 2001, pp. 1004-1009
Intramolecular charge transfer of pi-conjugated push-pull systems in termsof polarizability and electronegativity
Authors: Lee, JY Kim, KS Mhin, BJ
Citation: Jy. Lee et al., Intramolecular charge transfer of pi-conjugated push-pull systems in termsof polarizability and electronegativity, J CHEM PHYS, 115(20), 2001, pp. 9484-9489
A simple rule for classification of polychlorinated dibenzo-p-dioxin congeners on the basis of IR frequency patterns
Authors: Mhin, BJ Choi, J Choi, W
Citation: Bj. Mhin et al., A simple rule for classification of polychlorinated dibenzo-p-dioxin congeners on the basis of IR frequency patterns, J AM CHEM S, 123(15), 2001, pp. 3584-3587
Ab initio study of peroxyacetic nitric anhydride and peroxyacetyl radical:Characteristic infrared band of peroxyacetyl radical
Authors: Mhin, BJ Chang, WY Lee, JY Kim, KS
Citation: Bj. Mhin et al., Ab initio study of peroxyacetic nitric anhydride and peroxyacetyl radical:Characteristic infrared band of peroxyacetyl radical, J PHYS CH A, 104(12), 2000, pp. 2613-2617
Ab initio investigations on the HOSO2+O-2 -> SO3+HO2 reaction
Authors: Majumdar, D Kim, GS Kim, J Oh, KS Lee, JY Kim, KS Choi, WY Lee, SH Kang, MH Mhin, BJ
Citation: D. Majumdar et al., Ab initio investigations on the HOSO2+O-2 -> SO3+HO2 reaction, J CHEM PHYS, 112(2), 2000, pp. 723-730
Relationship between charge transfer and the structural deformation in para-substituted aniline derivatives
Authors: Mhin, BJ Park, BH
Citation: Bj. Mhin et Bh. Park, Relationship between charge transfer and the structural deformation in para-substituted aniline derivatives, CHEM P LETT, 325(1-3), 2000, pp. 61-68
The importance of thermodynamic quantities for the determination of the unknown conformation: Ab initio studies of K+(H2O)(3)
Authors: Lee, HM Son, HS Mhin, BJ
Citation: Hm. Lee et al., The importance of thermodynamic quantities for the determination of the unknown conformation: Ab initio studies of K+(H2O)(3), B KOR CHEM, 20(3), 1999, pp. 345-351
Aqua-potassium(I) complexes: Ab initio study
Authors: Lee, HM Kim, J Lee, S Mhin, BJ Kim, KS
Citation: Hm. Lee et al., Aqua-potassium(I) complexes: Ab initio study, J CHEM PHYS, 111(9), 1999, pp. 3995-4004
Photoswitch and nonlinear optical switch: Theoretical studies on 1,2-bis-(3-thienyl)-ethene derivatives
Authors: Majumdar, D Lee, HM Kim, J Kim, KS Mhin, BJ
Citation: D. Majumdar et al., Photoswitch and nonlinear optical switch: Theoretical studies on 1,2-bis-(3-thienyl)-ethene derivatives, J CHEM PHYS, 111(13), 1999, pp. 5866-5872
Risultati: 1-9 |