A KEY PLAYER FOR DESIGNING NOVEL ENERGY-RELATED MATERIALS: MULTI-SCALE SIMULATION BASED ON FIRST-PRINCIPLES AND REACTIVE FORCE FIELD

Authors
HAN Sang Soo
Publisher
AMER CHEMICAL SOC
Citation
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
Keywords
First principles; Reactive force field; Multiscale simulation; Catalyst; Battery
ISSN
0065-7727
URI
https://pubs.kist.re.kr/handle/201004/91649
Appears in Collections:
KIST Conference Paper > Others
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