화학공학소재연구정보센터
검색결과 : 10건
No. Article
1 Fundamental properties of single-wall carbon nanotubes
White CT, Mintmire JW
Journal of Physical Chemistry B, 109(1), 52, 2005
2 Molecular dynamics simulations of the oxidation of aluminum nanoparticles
Alavi S, Mintmire JW, Thompson DL
Journal of Physical Chemistry B, 109(1), 209, 2005
3 Local density approximation calculation of the conformation and electronic structure of poly(fluoroethylene)s
Miao MS, Zhang ML, Van Doren VE, Ladik JJ, Mintmire JW
Journal of Physical Chemistry A, 104(29), 6809, 2000
4 Calculation of the total energy per unit cell and of the band structures of the five nucleotide base stacks using the local-density approximation
Zhang ML, Miao MS, Van Doren VE, Ladik JJ, Mintmire JW
Journal of Chemical Physics, 111(18), 8696, 1999
5 First-principles calculation of the conformation and electronic structure of polyparaphenylene
Miao MS, Van Camp PE, Van Doren VE, Ladik JJ, Mintmire JW
Journal of Chemical Physics, 109(21), 9623, 1998
6 First-principles simulations of endohedral bromine in BC3 nanotubes
Jishi RA, White CT, Mintmire JW
Journal of Physical Chemistry B, 102(9), 1568, 1998
7 Molecular-Dynamics Simulations of Elastic Response and Tensile Failure of Alumina
Streitz FH, Mintmire JW
Langmuir, 12(19), 4605, 1996
8 Fullerene Formation and Annealing
Mintmire JW
Science, 272(5258), 45, 1996
9 CHARGE-TRANSFER AND BONDING IN METALLIC OXIDES
STREITZ FH, MINTMIRE JW
Journal of Adhesion Science and Technology, 8(8), 853, 1994
10 Electrostatic-Based Model for Alumina Surfaces
Streitz FH, Mintmire JW
Thin Solid Films, 253(1-2), 179, 1994