A. Hess

发表

LDA and GGA calculations of alkali metal adsorption at the (001) surface of MgO

M. Gutowski, Zijing Lin, J. A. Snyder, 2000 .

Adsorption of CO on MgO supported alkali monolayers: a periodic density functional local density approximation and generalized gradient approximation study

M. Gutowski, Zijing Lin, J. A. Snyder, 2000 .

High-coverage adsorption of alkali metals at the CaO and MgO (100) surfaces

M. Gutowski, J. Jaffe, A. Hess, 2000 .

Ab initio study of hydrogen adsorption on the ZnO (101̄0) surface

P. Zapol, A. Hess, J. Jaffe, 1999 .

Toward high-performance computational chemistry: II. A scalable self-consistent field program

David E. Bernholdt, Robert J. Harrison, Ian T. Foster, 1996, Journal of Computational Chemistry.

Correlation corrected periodic Hartree–Fock study of the interactions between water and the (001) magnesium oxide surface

A. Hess, M. I. Mccarthy, C. Scamehorn, 1993 .

Raman spectroscopic and optical absorption study of the high pressure behaviour and polymorphism in KO2

P. McMillan, A. Hess, R. Hanson, 1993 .

An electronic structure study of H2 and CH4 interactions with MgO and Li‐doped MgO clusters

K. Morokuma, A. Hess, J. Anchell, 1993 .

Ab initio force field of the S4 conformation of silicic acid (H4SiO4)

P. McMillan, A. Hess, M. O'Keeffe, 1987 .

Periodic ab initio Hartree-Fock calculations of the low-symmetry mineral kaolinite

V. Saunders, A. Hess, 1992 .

H2O DISSOCIATION AT LOW-COORDINATED SITES ON (MGO)N CLUSTERS, N = 4,8

A. Hess, J. Anchell, 1996 .

Ab initio valence force field calculations for quartz

P. McMillan, A. Hess, 1990 .

Torsional barriers and force fields in H4TO4 molecules and molecular ions (T = C, B, Al, Si)

P. McMillan, A. Hess, M. O'Keeffe, 1988 .

Periodic Hartree−Fock Characterization of the Structure and Electronic Properties of Zeolite NaCaA

J. Nicholas, A. Hess, Julian White, 1997 .

Formation of the c ( 1 × 1 ) Cu monolayer on CaO(100): A theoretical study

M. Gutowski, J. Jaffe, A. Hess, 2003 .

An ab Initio Periodic Hartree-Fock Study of Group IA Cations in ANA-Type Zeolites

A. Hess, M. Thompson, J. Anchell, 1994 .

Opposite rumpling of the MgO and CaO (100) surfaces: A density-functional theory study

M. Gutowski, J. A. Snyder, J. Jaffe, 2000 .

LDA and GGA calculations for high-pressure phase transitions in ZnO and MgO

James A. Snyder, Anthony C. Hess, J. A. Snyder, 2000 .

An examination of the electrostatic potential of silicalite using periodic Hartree-Fock theory

A. Hess, Julian White, 1993 .

First-Principles Studies of Adsorption of CO on the Na(100) Surface

M. Gutowski, J. A. Snyder, J. Jaffe, 2000 .

Gaussian basis density functional theory for systems periodic in two or three dimensions: Energy and forces

Anthony C. Hess, J. Jaffe, A. Hess, 1996 .

Force fields for SiF4 and H4SiO4: ab initio molecular orbital calculations

P. McMillan, A. Hess, M. O'Keeffe, 1986 .

Structural and vibrational properties of neopentane and tetramethylsilane using ab initio mo calculations

A. Hess, J. Guth, 1988 .

Main Features of the Electron Kinetics in Collision Dominated Steady-State rf Plasmas

A. Hess, J. Wilhelm, R. Winkler, 1985 .

AB INITIO PERIODIC HARTREE-FOCK INVESTIGATION OF A ZEOLITE ACID SITE

J. Nicholas, A. Hess, 1994 .

Basis sets for ab initio periodic Hartree—Fock studies of zeolite/adsorbate interactions: He, Ne, and Ar in silica sodalite

J. Nicholas, A. Hess, M. I. Mccarthy, 1996 .

A valence force field for diamond from ab initio molecular orbital cluster calculations

P. McMillan, W. Petuskey, A. Hess, 1990 .

Periodic Hartree–Fock studies of the properties of the Cl2/MgO (001) interface

A. Hess, M. I. Mccarthy, 1992 .

A study of the energetics of the Cl2/MgO(001) interface using correlation corrected periodic Hartree–Fock theory

N. Harrison, V. Saunders, A. Hess, 1993 .

Ab initio study of a CO monolayer adsorbed on the (101̄0) surface of ZnO

J. Jaffe, A. Hess, 1996 .

Topological defects at the (001) surface of MgO : energetics and reactivity

C. Pisani, A. Hess, R. Nada, 1995 .

AB INITIO STUDY OF ZNO (1010) SURFACE RELAXATION

N. Harrison, J. Jaffe, A. Hess, 1994 .

Periodic Hartree-Fock study of siliceous mordenite

Anthony C. Hess, A. Hess, Julia C. White, 1993 .

Gaussian-basis LDA and GGA calculations for alkali-metal equations of state

Zijing Lin, J. Jaffe, A. Hess, 1998 .

Mobile Fc region in the Zie IgG2 cryoglobulin: comparison of crystals of the F(ab')2 fragment and the intact immunoglobulin.

K. R. Ely, E. Abola, P. Colman, 1978, Biochemistry.

Hartree-Fock study of phase changes in ZnO at high pressure.

Hess, J. Jaffe, A. Hess, 1993, Physical review. B, Condensed matter.