Browse by Subject 1ST-PRINCIPLES CALCULATIONS

Showing results 1 to 6 of 6

1
A combined first principles and experimental study on Na3V2(PO4)(2)F-3 for rechargeable Na batteries

Shakoor, R. A.; Seo, Dong-Hwa; Kim, Hyungsub; Park, Young-Uk; Kim, Jongsoon; Kim, Sung-Wook; Gwon, Hyeokjo; et al, JOURNAL OF MATERIALS CHEMISTRY, v.22, no.38, pp.20535 - 20541, 2012

2
Computational exploration of borophane-supported single transition metal atoms as potential oxygen reduction and evolution electrocatalysts

Singh, Yashpal; Back, Seoin; Jung, Yousung, PHYSICAL CHEMISTRY CHEMICAL PHYSICS, v.20, no.32, pp.21095 - 21104, 2018-08

3
CsSnI3: Semiconductor or Metal? High Electrical Conductivity and Strong Near-Infrared Photoluminescence from a Single Material. High Hole Mobility and Phase-Transitions

Chung, In; Song, Jung-Hwan; Im, Jino; Androulakis, John; Malliakas, Christos D.; Li, Hao; Freeman, Arthur J.; et al, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.134, no.20, pp.8579 - 8587, 2012-05

4
Dielectric-screening properties and Coulomb pseudopotential mu(*) for MgB2

Moon, CY; Kim, Yong-Hyun; Chang, Kee-Joo, PHYSICAL REVIEW B, v.70, pp.104522 - 104522, 2004-09

5
Fermi-level pinning of Ag on Si(111)-(7x7)

C. Hwang; C.-S. Hwang; S. W. Lee; I.-S. Jeong; H. H. Park; S.-I. Tanaka; M. Kamada; et al, PHYSICAL REVIEW B, v.52, no.23, pp.16325 - 16328, 1995

6
Magnetic force theory combined with quasi-particle self-consistent GW method

Yoon, Hongkee; Jang, Seung Woo; Sim, Jae-Hoon; Kotani, Takao; Han, Myung Joon, JOURNAL OF PHYSICS-CONDENSED MATTER, v.31, no.40, pp.405503, 2019-10

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