Showing results 7 to 9 of 9
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 |
Theoretical study of the microscopic origin of magnetocrystalline anisotropy in Fe16N2 and its alloys: comparison with the other L1(0) alloys Han, Myung Hoon; Kim, Won June; Lee, Eok Kyun; Kim, Hyungjun; Lebegue, Sebastien; Kozak, John J., JOURNAL OF PHYSICS-CONDENSED MATTER, v.32, no.3, 2020-01 |
uMBD: A Materials-Ready Dispersion Correction That Uniformly Treats Metallic, Ionic, and van der Waals Bonding Kim, Minho; Kim, Won June; Gould, Timothy; Lee, Eok Kyun; Lebegue, Sebastien; Kim, Hyungjun, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.142, no.5, pp.2346 - 2354, 2020-02 |
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