CH-Journal Papers(저널논문)

Recent Items

Collection's Items (Sorted by Submit Date in Descending order): 4321 to 4340 of 5865

4321
A RELATIVISTIC CONFIGURATION-INTERACTION METHOD USING EFFECTIVE CORE POTENTIALS WITH SPIN-ORBIT INTERACTIONS

KIM, MC; LEE, SY; Lee, Yoon Sup, BULLETIN OF THE KOREAN CHEMICAL SOCIETY, v.16, no.6, pp.547 - 552, 1995-06

4322
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

4323
Spin-orbit effects on structures of closed-shell polyatomic molecules containing heavy atoms calculated by two-component Hartree-Fock method

Han, YK; Bae, C; Lee, Yoon Sup; Lee, SY, JOURNAL OF COMPUTATIONAL CHEMISTRY, v.19, no.13, pp.1526 - 1533, 1998-10

4324
Semiempirical calculations of substituent effects on the reactions of cephem-like beta-lactam molecules

Lee, JC; Koh, HY; Chang, MH; Lee, Yoon Sup, BULLETIN OF THE KOREAN CHEMICAL SOCIETY, v.17, no.7, pp.604 - 607, 1996-07

4325
Structures of RgF(n), (Rg = Xe, Rn, and element 118; n = 2, 4) calculated by two-component spin-orbit methods. A spin-orbit induced isomer of (118)F-4

Han, YK; Lee, Yoon Sup, JOURNAL OF PHYSICAL CHEMISTRY A, v.103, no.8, pp.1104 - 1108, 1999-02

4326
Two conformations of the integrin A-domain (I-domain): A pathway for activation?

Lee, Jie-Oh; Bankston, LA; Arnaout, MA; Liddington, RC, STRUCTURE, v.3, no.12, pp.1333 - 1340, 1995-12

4327
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

4328
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

4329
Structural basis for inhibition of the cyclin-dependent kinase Cdk6 by the tumour suppressor p16(INK4a)

Russo, AA; Tong, L; Lee, Jie-Oh; Jeffrey, PD; Pavletich, NP, NATURE, v.395, no.6699, pp.237 - 243, 1998-09

4330
Synthesis, Structures and Reactivities of Oxomolybdacarboranes: A Systematic Approach

Do, Youngkyu; KIM, J.-H; Spec. Publ; - R. Soc. Chem., SPECIAL PUBLICATIONS - ROYAL SOCIETY OF CHEMISTRY, v.201, pp.358 - 365, 1997

4331
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

4332
Structure of the retinoblastoma tumour-suppressor pocket domain bound to a peptide from HPV E7

Lee, Jie-Oh; Russo, AA; Pavletich, NP, NATURE, v.391, no.6670, pp.859 - 865, 1998-02

4333
A two-ellipsoid model based upon a Gaussian overlap potential

Yoo, JG; Lee, Yoon Sup, MOLECULAR SIMULATION, v.19, no.2, pp.93 - 116, 1997

4334
Determination of molecular orientational distribution using surface second-harmonic generation analyzed by five-layer model and maximum-entropy method

Yoo, JG; Hoshi, H; Sakai, T; Park, B; Ishikawa, K; Takezoe, H; Lee, Yoon Sup, JOURNAL OF APPLIED PHYSICS, v.84, no.8, pp.4079 - 4086, 1998-10

4335
Ab initio study of fluorocyclobutenes: an attempt to resolve the difference between microwave spectroscopy and electron diffraction geometries of hexafluorocyclobutene

Han, YK; Lee, Yoon Sup; Lee, SY; Kim, JT, THEOCHEM-JOURNAL OF MOLECULAR STRUCTURE, v.422, pp.25 - 33, 1998-01

4336
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

4337
Structures and stabilities for halides and oxides of transactinide elements Rf, Db, and Sg calculated by relativistic effective core potential methods

Han, YK; Son, SK; Choi, YJ; Lee, Yoon Sup, JOURNAL OF PHYSICAL CHEMISTRY A, v.103, no.45, pp.9109 - 9115, 1999-11

4338
Two-component calculations of spin-orbit effects for a van der Waals molecule Rn-2

Han, YK; Bae, C; Lee, Yoon Sup, INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, v.72, no.2, pp.139 - 143, 1999-03

4339
Computational study of medium-sized cumulenethiones H2CnS (n=3-9)

Park, SW; Park, K; Lee, S; Kim, Bongsoo, CHEMICAL PHYSICS LETTERS, v.326, no.5-6, pp.530 - 536, 2000-08

4340
Two-component calculations for the molecules containing superheavy elements: Spin-orbit effects for (117)H, (113)H, and (113)F

Han, YK; Bae, C; Lee, Yoon Sup, JOURNAL OF CHEMICAL PHYSICS, v.110, no.18, pp.8969 - 8975, 1999-05

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