| 1 |
LDA and GGA calculations of alkali metal adsorption at the (001) surface of MgO
Snyder JA, Jaffe JE, Gutowski M, Lin ZJ, Hess AC
Journal of Chemical Physics, 112(6), 3014, 2000 |
| 2 |
Periodic density functional LDA and GGA study of CO adsorption at the (001) surface of MgO
Snyder JA, Alfonso DR, Jaffe JE, Lin ZJ, Hess AC, Gutowski M
Journal of Physical Chemistry B, 104(19), 4717, 2000 |
| 3 |
Multicenter integration scheme for electronic structure calculations of periodic and nonperiodic polyatomic systems
Lin ZJ, Jaffe JE, Hess AC
Journal of Physical Chemistry A, 103(13), 2117, 1999 |
| 4 |
Periodic Hartree-Fock study of LixTiS2, 0<=x<=1: The structural, plastic, and electronic effects of lithium intercalation in TiS2
Clerc DG, Poshusta RD, Hess AC
Journal of Physical Chemistry A, 101(47), 8926, 1997 |
| 5 |
Periodic Hartree-Fock Characterization of the Structure and Electronic-Properties of Zeolite NaCaA
White JC, Nicholas JB, Hess AC
Journal of Physical Chemistry B, 101(4), 590, 1997 |
| 6 |
Ab-Initio Study of a Co Monolayer Adsorbed on the (10(1)over-Bar-0) Surface of ZnO
Jaffe JE, Hess AC
Journal of Chemical Physics, 104(9), 3348, 1996 |
| 7 |
Gaussian-Basis Density-Functional Theory for Systems Periodic in 2 or 3 Dimensions - Energy and Forces
Jaffe JE, Hess AC
Journal of Chemical Physics, 105(24), 10983, 1996 |
| 8 |
Periodic Hartree-Fock Study of Tis2
Clerc DG, Poshusta RD, Hess AC
Journal of Physical Chemistry, 100(39), 15735, 1996 |
| 9 |
H2O Dissociation at Low-Coordinated Sites on (MgO)(N) Clusters, N=4,8
Anchell JL, Hess AC
Journal of Physical Chemistry, 100(47), 18317, 1996 |
| 10 |
An Ab-Initio Periodic Hartree-Fock Study of Group Ia Cations in ANA-Type Zeolites
Anchell JL, White JC, Thompson MR, Hess AC
Journal of Physical Chemistry, 98(16), 4463, 1994 |
