J. Anchell

发表

NWChem: Past, present, and future.

T. Straatsma, V. Tipparaju, J. Nieplocha, 2020, The Journal of chemical physics.

A Concise Description of the Bulk Structure of Vanadyl Pyrophosphate and Implications for n-Butane Oxidation

J. Nicholas, M. Thompson, J. Whitea, 1994 .

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.

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

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

Self‐Consistent‐Field potential‐energy surfaces for hydrogen atom pairs within small palladium clusters

J. Simons, J. Nichols, M. Gutowski, 1992 .

Supplementary Material (ESI) for PCCP This journal is © the Owner Societies 2011 The Energetics of Covalent and Non-covalent Binding in Complexes Containing Phosphate and Cationic Amino Groups

R. Littlefield, V. Tipparaju, J. Nieplocha, 2011 .

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

A. Hess, J. Anchell, 1996 .

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

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

NWChem: Past, present, and future.

Jeffery S. Boschen, Nicholas P. Bauman, T. Straatsma, 2020, The Journal of chemical physics.

Quantum and classical descriptions of position and phase‐space densities of a model Hamiltonian

J. Anchell, 1990 .

Position, momentum, and phase‐space one‐electron densities of H2, N2, and LiH

J. Anchell, J. E. Harriman, 1988 .

The Husimi function for electron distributions

M. E. Casida, J. Anchell, J. E. Harriman, 1987 .