Browse "MS-Journal Papers(저널논문)" by Subject PSEUDOPOTENTIALS
Showing results 1 to 3 of 3
| Preferential segregation of Pd atoms in the Ag-Pd bimetallic cluster: Density functional theory and molecular dynamics simulation Kim, Hyun-You; Kim, Hyoung-Gyu; Ryu, Ji-Hoon; Lee, Hyuck-Mo, PHYSICAL REVIEW B, v.75, no.21, pp.212105-1 - 212105-4, 2007-06 |
| Tailored field-emission property of patterned carbon nitride nanotubes by a selective doping of substitutional N(sN) and pyridine-like N(pN) atoms Zhong, Zhigang; Lee, Ga-In; Bin Mo, Chan; Hong, Soon Hyung; Kang, Jeung-Ku, CHEMISTRY OF MATERIALS, v.19, no.12, pp.2918 - 2920, 2007-06 |
| The theoretical study on interaction of hydrogen with single-walled boron nitride nanotubes. I. The reactive force field ReaxFF(HBN) development Han, SS; Kang, Jeung Ku; Lee, HyuckMo; van Duin, ACT; Goddard, WA, JOURNAL OF CHEMICAL PHYSICS, v.123, no.11, pp.4381 - 4396, 2005-09 |
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