Browse "EEW-Journal Papers(저널논문)" by Subject DFT

Showing results 3 to 4 of 4

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Structural Elucidation of Covalent Organic Polymers (COP) and Their Linker Effect on Gas Adsorption Performance via Density Functional Theory Approach

Aparicio, Santiago; Yavuz, Cafer T; Atilhan, Mert, CHEMISTRYSELECT, v.3, no.28, pp.8294 - 8305, 2018-07

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Suppression of Hydrogen Evolution Reaction in Electrochemical N2 Reduction Using Single-Atom Catalysts: A Computational Guideline

Choi, Changhyeok; Back, Seoin; Kim, Na Young; Lim, Juhyung; Kim, Yong-Hyun; Jung, Yousung, ACS CATALYSIS, v.8, no.8, pp.7517 - 7525, 2018-08

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