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Showing results 1 to 4 of 4

1
A rational method to kinetically control the rate-determining step to explore efficient electrocatalysts for the oxygen evolution reaction

Kwon, Nam Hee; Kim, Minho; Jin, Xiaoyan; Lim, Joohyun; Kim, In Young; Lee, Nam-Suk; Kim, Hyungjun; et al, NPG ASIA MATERIALS, v.10, pp.659 - 669, 2018-07

2
Analytic Derivatives of Quartic-Scaling Doubly Hybrid XYGJ-OS Functional: Theory, Implementation, and Benchmark Comparison with M06-2X and MP2 Geometries for Nonbonded Complexes

Ji, Hyunjun; Shao, Yihan; Goddard, William A.; Jung, Yousung, JOURNAL OF CHEMICAL THEORY AND COMPUTATION, v.9, no.4, pp.1971 - 1976, 2013-04

3
Benchmarking several van der Waals dispersion approaches for the description of intermolecular interactions

Claudot, Julien; Kim, Won June; Dixit, Anant; Kim, Hyungjun; Gould, Tim; Rocca, Dario; Lebegue, Sebastien, JOURNAL OF CHEMICAL PHYSICS, v.148, no.6, 2018-02

4
Recent development of atom-pairwise van der waals corrections for density functional theory: From molecules to solids

Kim, Minho; Kim, Won-June; Lee, Eok Kyun; Lebegue, Sebastien; Kim, Hyungjun, INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, v.116, no.8, pp.598 - 607, 2016-04

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