Browse "CH-Journal Papers(저널논문)" by Author Lee, Yoon Sup
Showing results 62 to 121 of 181
| Effects of intramolecular basis set superposition error on conformational energy difference of 1,2-difluoroethane and 1,2-dimethoxyethane Han, YK; Kim, KH; Son, SK; Lee, Yoon Sup, BULLETIN OF THE KOREAN CHEMICAL SOCIETY, v.23, no.9, pp.1267 - 1271, 2002 |
| Effects of relativity and of the lanthanide contraction on the atoms from hafnium to bismuth S. Bagus, P.; Lee, Yoon Sup; Pitzer, K.S., CHEMICAL PHYSICS LETTERS, v.33, no.3, pp.408 - 411, 1975-06 |
| Effects of the magnetic part of the Breit term on bonding: Model calculations with small diatomic molecules Ryu, S; Baeck, KK; Han, YK; Lee, Yoon Sup, BULLETIN OF THE KOREAN CHEMICAL SOCIETY, v.22, no.9, pp.969 - 974, 2001-09 |
| EFFECTS OF THE MAGNETIC PART OF THE BREIT TERM ON THE (2)PI STATES OF DIATOMIC HYDRIDES BAECK, KK; Lee, Yoon Sup, JOURNAL OF CHEMICAL PHYSICS, v.100, no.4, pp.2888 - 2895, 1994-02 |
| Elastic scattering of cold caesium and rubidium atoms Jamieson, MJ; Sarbazi-Azad, H; Ouerdane, H; Jeung, GH; Lee, Yoon Sup; Lee, WC, JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS, v.36, no.6, pp.1085 - 1097, 2003-03 |
| ELECTRON CORRELATION-EFFECTS ON THE STRUCTURE OF ALL 3DN4SM VALENCE STATES OF TI, V, AND CR AND THEIR IONS AS STUDIED BY QUASI-DEGENERATE MANY-BODY PERTURBATION-THEORY Lee, Yoon Sup; FREED, KF, JOURNAL OF CHEMICAL PHYSICS, v.77, no.4, pp.1984 - 2001, 1982 |
| ELECTRONIC-STRUCTURE CALCULATIONS FOR ARCO2+ AND ARCO2 HWANG, WL; Lee, Yoon Sup; KIM, JH, BULLETIN OF THE KOREAN CHEMICAL SOCIETY, v.9, no.3, pp.153 - 156, 1988-06 |
| Energies and structures of isomers of Cl2O2 calculated by density functional methods Han, YK; Kim, KH; Lee, Yoon Sup; Baeck, KK, THEOCHEM-JOURNAL OF MOLECULAR STRUCTURE, v.431, no.1-2, pp.185 - 189, 1998-04 |
| Experimental and theoretical study of the photodissociation reaction of thiophenol at 243 nm: Intramolecular orbital alignment of the phenylthiyl radical Lim, Ivan S.; Lim, Jeong Sik; Lee, Yoon Sup; Kim, Sangkyu, JOURNAL OF CHEMICAL PHYSICS, v.126, no.3, pp.2080 - 2095, 2007-01 |
| Experimental and theoretical study on the reaction Sc+NO -> ScO+N Jeung, GH; Luc, P; Vetter, R; Kim, KH; Lee, Yoon Sup, PHYSICAL CHEMISTRY CHEMICAL PHYSICS, v.4, no.4, pp.596 - 600, 2002 |
| Favorable pendant-amino metal chelation in VX nerve agent model systems Bandyopadhyay, I; Kim, MJ; Lee, Yoon Sup; Churchill, David G, JOURNAL OF PHYSICAL CHEMISTRY A, v.110, no.10, pp.3655 - 3661, 2006-03 |
| FINITE-ELEMENT BASIS FOR THE EXPANSION OF RADIAL WAVE-FUNCTION IN QUANTUM SCATTERING CALCULATIONS HWANG, WG; Lee, Yoon Sup; PARK, SC, CHEMICAL PHYSICS LETTERS, v.187, no.1-2, pp.180 - 186, 1991-11 |
| First hyperpolarizability orientation in asymmetric pyrrole-based polyene chromophores Kwon, O-Pil; Jazbinsek, Mojca; Seo, Jung-In; Kim, Pil-Joo; Choi, Eun-Young; Lee, Yoon Sup; Guenter, Peter, DYES AND PIGMENTS, v.85, no.3, pp.162 - 170, 2010-05 |
| 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 |
| Fluorescence probing of the ferric Fenton reaction via novel chelation Murale, Dhiraj Padmakar; Manjare, Sudesh T.; Lee, Yoon Sup; Churchill, David G, CHEMICAL COMMUNICATIONS, v.50, no.3, pp.359 - 361, 2014-01 |
| Geminal substituent effects on decyanation reactions Lee, JC; Koh, HY; Lee, Yoon Sup; Kang, HY, BULLETIN OF THE KOREAN CHEMICAL SOCIETY, v.18, no.7, pp.783 - 785, 1997-07 |
| Heavy-element effect on the splitting of the A(2)Pi state of the LiRg (Rg = Ar, Kr and Xe) complexes Park, SJ; Lee, Yoon Sup; Jeung, GH, CHEMICAL PHYSICS LETTERS, v.325, no.5-6, pp.678 - 682, 2000-08 |
High Hydrogen Capacity and Reversibility of K-Decorated Silicon Materials Park, Min Hee; Ryu, Seol; Han, Young-Kyu; Lee, Yoon Sup, BULLETIN OF THE KOREAN CHEMICAL SOCIETY, v.33, no.5, pp.1719 - 1721, 2012-05 |
| High-dimensional manganese(II) compounds with noncovalent and/or covalent bonds derived from flexible ligands: Self-assembly and structural transformation Hong, CS; Son, SK; Lee, Yoon Sup; Jun, MJ; Do, Youngkyu, INORGANIC CHEMISTRY, v.38, no.24, pp.5602 - 5610, 1999-11 |
| High-power Broadband Organic THz Generator Jeong, Jae-Hyeok; Kang, Bong-Joo; Kim, Ji-Soo; Jazbinsek, Mojca; Lee, Seung-Heon; Lee, Seung-Chul; Baek, In-Hyung; et al, SCIENTIFIC REPORTS, v.3, 2013-11 |
| Highly nonlinear optical configurationally locked triene crystals based on 3,5-dimethyl-2-cyclohexen-1-one Kwon, Seong-Ji; Kwon, O-Pil; Seo, Jung-In; Jazbinsek, Mojea; Mutter, Lukas; Gramlich, Volker; Lee, Yoon Sup; et al, JOURNAL OF PHYSICAL CHEMISTRY C, v.112, no.21, pp.7846 - 7852, 2008-05 |
| IMPROVED ABINITIO EFFECTIVE CORE POTENTIALS FOR MOLECULAR CALCULATIONS CHRISTIANSEN, PA; Lee, Yoon Sup; PITZER, KS, JOURNAL OF CHEMICAL PHYSICS, v.71, no.11, pp.4445 - 4450, 1979 |
| IMPROVED ABINITIO EFFECTIVE POTENTIALS FOR AR, KR, AND XE WITH APPLICATIONS TO THEIR HOMONUCLEAR DIMERS Christiansen, P.A.; Pitzer, K.S.; Lee, Yoon Sup; Yates, J.H.; Ermler, W.C.; Winter, N.W., THE JOURNAL OF CHEMICAL PHYSICS, v.75, no.11, pp.5410 - 5415, 1981 |
| Influence of charge transfer characteristics on size-related effects of organic nanoparticles Rim, Min Ho; Seo, Jung-In; Lee, Yoon Sup; Yoon, Choon Sup, CHEMICAL PHYSICS LETTERS, v.477, no.4-6, pp.349 - 354, 2009-08 |
| Influence of phenolic hydroxyl groups on second-order optical nonlinearity at an example of 2,4-and 3,4-dihydroxyl hydrazone isomorphic crystals Kwon, O-Pil; Jazbinsek, Mojca; Seo, Jung-In; Choi, Eun-Young; Yun, Hoseop; Brunner, Fabian D. J.; Lee, Yoon Sup; et al, JOURNAL OF CHEMICAL PHYSICS, v.130, no.13, 2009-04 |
| INOR 235-Favorable pendant-amino metal chelation in VX nerve agent model systems Bandyopadhyay, Indrajit; Kim, Minjung; Lee, Yoon Sup; Churchill, David G, ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, v.235, 2008-04 |
| INTERNAL ROTATIONAL BARRIERS OF ETHYL HALIDES FROM SCF CALCULATIONS Lee, Yoon Sup; RYU, US, BULLETIN OF THE KOREAN CHEMICAL SOCIETY, v.8, no.3, pp.221 - 223, 1987-06 |
| Intramolecular orbital alignment observed in the photodissociation of [D-1]Thiophenol Lim, Jeong Sik; Lim, Ivan S.; Lee, Kyoung-Seok; Ahn, Doo-Sik; Lee, Yoon Sup; Kim, Sangkyu, ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, v.45, no.38, pp.6290 - 6293, 2006 |
| KPACK: Relativistic Two-component Ab Initio Electronic Structure Program Package Kim, Inkoo; Lee, Yoon Sup, BULLETIN OF THE KOREAN CHEMICAL SOCIETY, v.34, no.1, pp.179 - 187, 2013-01 |
| KRAMERS RESTRICTED HARTREE-FOCK METHOD FOR POLYATOMIC-MOLECULES USING ABINITIO RELATIVISTIC EFFECTIVE CORE POTENTIALS WITH SPIN ORBIT OPERATORS LEE, SY; Lee, Yoon Sup, JOURNAL OF COMPUTATIONAL CHEMISTRY, v.13, no.5, pp.595 - 601, 1992-06 |
| Kramers unrestricted Hartree-Fock and second-order Moller-Plesset perturbation methods using relativistic effective core potentials with spin-orbit operators: Test calculations for HI and CH3I Kim, YS; Lee, SY; Oh, WS; Park, BH; Han, YK; Park, SJ; Lee, Yoon Sup, INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, v.66, no.1, pp.91 - 98, 1998-01 |
| Laser control of the RbCs bond Chang, Bo Y.; Shin, Seokmin; Park, Young-Choon; Lee, Yoon Sup; Sola, Ignacio R., EUROPEAN PHYSICAL JOURNAL D, v.71, no.6, 2017-06 |
| Local intermolecular interactions for selective CO2 capture by zeolitic imidazole frameworks: energy decomposition analysis Park, Ji Young; Lee, Yoon Sup; Jung, Yousung, JOURNAL OF NANOPARTICLE RESEARCH, v.14, no.4, 2012-04 |
| Low-lying states of Tl-2 calculated by the configuration interaction methods based upon relativistic effective core potentials and two-component spinors Kim, MC; Lee, HS; Lee, Yoon Sup; Lee, SY, JOURNAL OF CHEMICAL PHYSICS, v.109, no.21, pp.9384 - 9390, 1998-12 |
| Molecular orbital studies of bonding characters of Al-N, Al-C, and N-C bonds in organometallic precursors to AlN thin films Lee, KH; Park, SS; Lee, HM; Park, SJ; Park, HS; Lee, Yoon Sup; Kim, Y; et al, BULLETIN OF THE KOREAN CHEMICAL SOCIETY, v.19, no.12, pp.1314 - 1319, 1998-12 |
| Molecular properties and potential energy surfaces of the cyanides of the groups 1 and 11 metal atoms Lee, Dong-ki; Lim, Ivan S.; Lee, Yoon Sup; Hagebaum-Reignier, Denis; Jeung, Gwang-Hi, JOURNAL OF CHEMICAL PHYSICS, v.126, no.24, pp.105 - 113, 2007-06 |
| Molecular Structures, Energetics, and Electronic Properties of Neutral and Charged Hg(n) Clusters (n=2-8) Kang, Jeewon; Kim, Joonghan; Ihee, Hyotcherl; Lee, Yoon Sup, JOURNAL OF PHYSICAL CHEMISTRY A, v.114, no.18, pp.5630 - 5639, 2010-05 |
| New Acentric Core Structure for Organic Electrooptic Crystals Optimal for Efficient Optical-to-THz Conversion Lee, Seung-Heon; Kang, Bong-Joo; Kim, Ji-Soo; Yoo, Ba-Wool; Jeong, Jae-Hyeok; Lee, Kang-Hyun; Jazbinsek, Mojca; et al, ADVANCED OPTICAL MATERIALS, v.3, no.6, pp.756 - 762, 2015-06 |
| New acentric quinolinium crystal with high order parameter for nonlinear optical and electro-optic applications Kim, Pil-Joo; Jazbinsek, Mojca; Jeong, Jae-Hyeok; Kim, Jong-Taek; Lee, Yoon Sup; Jung, Yeong-Min; Lee, Soon W.; et al, CRYSTENGCOMM, v.14, no.10, pp.3633 - 3637, 2012 |
| New quiolinium polymorph with optimal packing for maximal off-diagonal nonlinear optical response Lee, Seung-Heon; Jazbinsek, Mojca; Yun, Hoseop; Kim, Jong-Taek; Lee, Yoon Sup; Kwon, O-Pil, DYES AND PIGMENTS, v.96, no.2, pp.435 - 439, 2013-02 |
| Novel Reversible Zn2+-Assisted Biological Phosphate "Turn-On' Probing through Stable Aryl-hydrazone Salicylaldimine Conjugation That Attenuates Ligand Hydrolysis Tsay, Olga G.; Manjare, ST; Kim, Hyungjun; Lee, Kang Mun; Lee, Yoon Sup; Churchill, DG, INORGANIC CHEMISTRY, v.52, no.17, pp.10052 - 10061, 2013-09 |
| On the consistent definition of spin-orbit effects calculated by relativistic effective core potentials with one-electron spin-orbit operators: Comparison of spin-orbit effects for Tl, TlH, TlH3, PbH2, and PbH4 Han, YK; Bae, C; Lee, Yoon Sup, JOURNAL OF CHEMICAL PHYSICS, v.110, no.19, pp.9353 - 9359, 1999-05 |
| One-photon mass-analyzed threshold ionization spectroscopy of CH2BrI: Extensive bending progression, reduced steric effect, and spin-orbit effect in the cation Lee, M; Kim, H; Lee, Yoon Sup; Kim, MS, JOURNAL OF CHEMICAL PHYSICS, v.123, no.2, 2005-07 |
| Optical Nature and Binding Energetics of Fluorescent Fluoride Sensor Bis(bora)calix[4]arene and Design Strategies of Its Homologues Jin, Jaehyeok; Park, Ji Young; Lee, Yoon Sup, JOURNAL OF PHYSICAL CHEMISTRY C, v.120, no.42, pp.24324 - 24334, 2016-10 |
| Optical Nonlinearities and Molecular Conformations in Thiophene-Based Hydrazone Crystals Kwon, O-Pil; Jazbinsek, Mojca; Seo, Jung-In; Kim, Pil-Joo; Yun, Hoseop; Lee, Yoon Sup; Guenter, Peter, JOURNAL OF PHYSICAL CHEMISTRY C, v.113, no.34, pp.15405 - 15411, 2009-08 |
| OPTIMAL USE OF THE RECURRENCE RELATIONS FOR THE EVALUATION OF MOLECULAR INTEGRALS OVER CARTESIAN GAUSSIAN-BASIS FUNCTIONS RYU, U; KIM, M; Lee, Yoon Sup, JOURNAL OF COMPUTATIONAL CHEMISTRY, v.14, no.1, pp.30 - 36, 1993-01 |
| Organic Phenolic Configurationally Locked Polyene Single Crystals for Electro-optic and Terahertz Wave Applications Kwon, O-Pil; Kwon, Seong-Ji; Jazbinsek, Mojca; Brunner, Fabian D. J.; Seo, Jung-In; Hunziker, Christoph; Schneider, Arno; et al, ADVANCED FUNCTIONAL MATERIALS, v.18, no.20, pp.3242 - 3250, 2008-10 |
| Photodissociation Dynamics of Thiophenol-d(1): The Nature of Excited Electronic States along the S-D Bond Dissociation Coordinate Lim, Jeong Sik; Choi, Heechol; Lim, Ivan S.; Park, Seong Byung; Lee, Yoon Sup; Kim, Sangkyu, JOURNAL OF PHYSICAL CHEMISTRY A, v.113, no.39, pp.10410 - 10416, 2009-10 |
| PHYS 523-Photodissociation dynamics of thiophenol: Observation of the intramolecular orbital alignment Lim, Jeong Sik; Lim, Ivan S.; Lee, Yoon Sup; Kim, Sangkyu, ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, v.234, 2007-08 |
| pi-pi Interaction energies in monosubstituted-benzene dimers in parallel- and antiparallel-displaced conformations Seo, Jung-In; Kim, Inkoo; Lee, Yoon Sup, CHEMICAL PHYSICS LETTERS, v.474, no.1-3, pp.101 - 106, 2009-05 |
| Polymeric light emitting properties and structural relationships of fluorene-based conjugated copolymers containing various hole transporting derivatives Park, Jong-Hwa; Cho, Nam Sung; Jung, Young Kwan; Cho, Hoon-Je; Shim, Hong Ku; Kim, Hyoseok; Lee, Yoon Sup, ORGANIC ELECTRONICS, v.8, no.2-3, pp.272 - 285, 2007 |
| Potential energy surfaces for LiH2 and photochemical reactions Li*+H-2 <-> LiH+H Lee, HS; Lee, Yoon Sup; Jeung, GH, JOURNAL OF PHYSICAL CHEMISTRY A, v.103, no.50, pp.11080 - 11088, 1999-12 |
| Potential energy surfaces for the photochemical reactions Ca-*+H-2 -> CaH+H Kim, KH; Lee, HS; Lee, Yoon Sup; Jeung, GH, JOURNAL OF CHEMICAL PHYSICS, v.116, no.2, pp.589 - 593, 2002-01 |
| Potential energy surfaces for the reaction Al+O-2 -> AlO+O Ledentu, V; Rahmouni, A; Jeung, GH; Lee, Yoon Sup, BULLETIN OF THE KOREAN CHEMICAL SOCIETY, v.25, pp.1645 - 1647, 2004-11 |
| Pyrrole-Based Hydrazone Organic Nonlinear Optical Crystals and Their Polymorphs Kwon, O-Pil; Jazbinsek, Mojca; Yun, Hoseop; Seo, Jung-In; Kim, Eun-Mi; Lee, Yoon Sup; Guenter, Peter, CRYSTAL GROWTH & DESIGN, v.8, no.11, pp.4021 - 4025, 2008-11 |
| Quantum chemical analysis of salen-aluminum complexes for organic light emitting diodes Kim, Hyoseok; Lee, Yoon Sup, CHEMICAL PHYSICS LETTERS, v.585, pp.143 - 148, 2013-10 |
| QUENCHING OF I2 VAPOR FLUORESCENCE EXCITED WITH HE-NE-LASER LIGHT - A KINETICS-SPECTROSCOPY EXPERIMENT DUCHIN, KL; Lee, Yoon Sup; MILLS, JW, JOURNAL OF CHEMICAL EDUCATION, v.50, no.12, pp.858 - 861, 1973 |
| RAMAN-SPECTROSCOPIC STUDY OF 1,2-ETHANEDITHIOL ADSORBED ON SILVER SURFACE KWON, CK; KIM, K; KIM, MS; Lee, Yoon Sup, JOURNAL OF MOLECULAR STRUCTURE, v.197, pp.171 - 180, 1989-06 |
| RELATIVISTIC EFFECTS ON ORBITAL ENERGIES IN AGH AND AUH - A CLUE TO THE ORIGIN OF RELATIVISTIC CORRELATION-EFFECTS Lee, Yoon Sup; MCLEAN, AD, BULLETIN OF THE KOREAN CHEMICAL SOCIETY, v.8, no.2, pp.122 - 126, 1987-04 |
| RELATIVISTIC EFFECTS ON RE AND DE IN AGH AND AUH FROM ALL-ELECTRON DIRAC HARTREE-FOCK CALCULATIONS Lee, Yoon Sup; MCLEAN, AD, JOURNAL OF CHEMICAL PHYSICS, v.76, no.1, pp.735 - 736, 1982 |
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