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사진
Lee, Eok-Kyun (이억균)
교수, Department of Chemistry(화학과)
Research Area
Physical Chemistry, Theoretical Chemistry, Computational Chemistry
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    NO Title, Author(s) (Publication Title, Volume Issue, Page, Issue Date)
    1
    Density-dependent finite system-size effects in equilibrium molecular dynamics estimation of shear viscosity: Hydrodynamic and configurational study

    Kim, Kang-Sahn; Kim, Changho; Karniadakis, George Em; et al, JOURNAL OF CHEMICAL PHYSICS, v.151, no.10, 2019-09

    2
    Electronic Structure and Band Alignments of Various Phases of Titania Using the Self-Consistent Hybrid Density Functional and DFT plus U Methods

    Kim, Won June; Han, Myung Hoon; Lebegue, Sebastian; et al, FRONTIERS IN CHEMISTRY, v.7, 2019-02

    3
    Nature of intrinsic uncertainties in equilibrium molecular dynamics estimation of shear viscosity for simple and complex fluids

    Kim, Kang-Sahn; Han, Myung Hoon; Kim, Changho; et al, JOURNAL OF CHEMICAL PHYSICS, v.149, no.4, 2018-07

    4
    First-Principles Studies on Twinnability of Magnesium Alloys: Effects of Yttrium and Lithium on Compression Twinning Deformation Processes

    Kim, Won June; Han, Kyeong Hwan; Lee, Young Joo; et al, METALS AND MATERIALS INTERNATIONAL, v.24, no.4, pp.720 - 729, 2018-07

    5
    Cluster Expansion Method for Simulating Realistic Size of Nanoparticle Catalysts with an Application in CO2 Electroreduction

    Eom, Taedaehyeong; Kim, Won June; Lim, Hyung-Kyu; et al, JOURNAL OF PHYSICAL CHEMISTRY C, v.122, no.16, pp.9245 - 9254, 2018-04

    6
    Molecular hydrodynamics: Vortex formation and sound wave propagation

    Han, Kyeong Hwan; Kim, Changho; Talkner, Peter; et al, JOURNAL OF CHEMICAL PHYSICS, v.148, no.2, 2018-01

    7
    Nature of self-diffusion in two-dimensional fluids

    Choi, Bongsik; Han, Kyeong Hwan; Kim, Changho; et al, NEW JOURNAL OF PHYSICS, v.19, 2017-12

    8
    Failure of Density Functional Dispersion Correction in Metallic Systems and Its Possible Solution Using a Modified Many-Body Dispersion Correction

    Kim, Won June; Kim, Minho; Lee, Eok-Kyunresearcher; et al, JOURNAL OF PHYSICAL CHEMISTRY LETTERS, v.7, no.16, pp.3278 - 3283, 2016-08

    9
    Tuned Chemical Bonding Ability of Au at Grain Boundaries for Enhanced Electrochemical CO2 Reduction

    Kim, Kang-Sahn; Kim, Won June; Lim, Hyung Kyu; et al, ACS CATALYSIS, v.6, no.7, pp.4443 - 4448, 2016-07

    10
    Recent development of atom-pairwise van der waals corrections for density functional theory: From molecules to solids

    Kim, Minho; Kim, Won-June; Lee, Eok Kyunresearcher; et al, INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, v.116, no.8, pp.598 - 607, 2016-04

    11
    First-Principles Study of the alpha-beta Phase Transition of Ferroelectric Poly(vinylidene difluoride): Observation of Multiple Transition Pathways

    Kim, Won June; Han, Myung Hoon; Shin, Young-Han; et al, JOURNAL OF PHYSICAL CHEMISTRY B, v.120, no.12, pp.3240 - 3249, 2016-03

    12
    Normal versus anomalous self-diffusion in two-dimensional fluids: Memory function approach and generalized asymptotic Einstein relation

    Shin, Hyun Kyung; Choi, Bongsik; Talkner, Peter; et al, JOURNAL OF CHEMICAL PHYSICS, v.141, no.21, 2014-12

    13
    Density functional study of alpha-beta phase transition of polyvinylidene difluoride

    Heo, Won-Joon; Kim, Won-June; Shin, Young-Han; et al, PHYSICA STATUS SOLIDI-RAPID RESEARCH LETTERS, v.6, no.5, pp.217 - 219, 2012-05

    14
    Thermodynamics of d-dimensional hard sphere fluids confined to micropores

    Kim, Hyungjunresearcher; Goddard, William A.; Han, Kyeong Hwan; et al, JOURNAL OF CHEMICAL PHYSICS, v.134, no.11, 2011-03

    15
    Fast Domain Wall Switching in a Thin Ferroelectric Polymer Layer

    Son, Jong Yeog; Shin, Yun-Sok; Shin, Young-Han; et al, ELECTROCHEMICAL AND SOLID STATE LETTERS, v.14, no.1, pp.1 - 3, 2011

    16
    Brownian motion from molecular dynamics

    Shin, Hyun Kyung; Kim, Changho; Talkner, Peter; et al, CHEMICAL PHYSICS, v.375, no.2-3, pp.316 - 326, 2010-10

    17
    Topological Quantities Determining the Folding/Unfolding Rate of Two-state Folding Proteins

    Jung, J; Buglass, Alan Jresearcher; Lee, Eok Kyunresearcher, JOURNAL OF SOLUTION CHEMISTRY, v.39, pp.943 - 958, 2010-07

    18
    Rate description of Fokker-Planck processes with time-periodic parameters

    Kim, Changho; Talkner, Peter; Lee, Eok Kyunresearcher; et al, CHEMICAL PHYSICS, v.370, no.1-3, pp.277 - 289, 2010-05

    19
    Effects of nonmagnetic impurities on the spin transport property of a graphene nanoribbon device

    Park, Joon-Ho; Yang, Heok; Park, K. -S.; et al, JOURNAL OF CHEMICAL PHYSICS, v.130, no.21, 2009-06

    20
    Wall-mediated self-diffusion in slit and cylindrical pores

    Kim, Hyungjunresearcher; Kim, Changho; Lee, Eok Kyunresearcher; et al, PHYSICAL REVIEW E, v.77, no.3, 2008-03

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