Browse by Subject Ab initio calculation

Showing results 1 to 3 of 3

1
Application of relativistic effective core potentials = 상대론적 유효 중심 포텐셜의 응용link

Park, Young-Choon; 박영춘; et al, 한국과학기술원, 2013

2
Ground and low-lying excited states of PtCN and PdCN: theoretical investigation including spin-orbit coupling

Moon, Jiwon; Kim, Tae Kyu; Kim, Joonghan, THEORETICAL CHEMISTRY ACCOUNTS, v.135, no.5, 2016-04

3
Ni-stabilizing additives for completion of Ni-rich layered cathode systems in lithium-ion batteries: An Ab initio study

Kim, Dong Young; Park, Insun; Shin, Yongwoo; Seo, Dong-Hwa; Kang, Yoon-Sok; Doo, Seok-Gwang; Koh, Meiten, JOURNAL OF POWER SOURCES, v.418, pp.74 - 83, 2019-04

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