F. W. Averill

发表

Calculations of molecular ionization energies using a self‐consistent‐charge Hartree–Fock–Slater method

H. Adachi, D. Ellis, A. Rosen, 1976 .

An efficient numerical multicenter basis set for molecular orbital calculations: Application to FeCl4

D. Ellis, F. W. Averill, Donald E Ellis, 1973 .

Embedded-cluster self-consistent partial-wave method: Extending the spatial scale of electronic structure calculations

F. W. Averill, G. S. Painter, 2008 .

Virial theorem in the density-functional formalism: Forces in H/sub 2/

F. W. Averill, G. S. Painter, 1981 .

Lattice strain effects in graphane and partially-hydrogenated graphene sheets

B. Pan, James R. Morris, Haiyan He, 2009 .

First-principles study of rare earth adsorption at {beta}-Si{sub 3}N{sub 4} interfaces

S. Pennycook, N. Shibata, K. Benthem, 2008 .

Molecular cluster theory of CO chemisorption on a nickel /100/ surface

E. Baerends, H. Adachi, D. Ellis, 1977 .

Electronic structure of FeCl4 anions in the Hartree‐Fock‐Slater model

D. Ellis, F. W. Averill, 1974 .

Augmented Gaussian-orbital basis for atomic-cluster calculations within the density-functional formalism: Application to Cu/sub 2/

F. W. Averill, G. S. Painter, 1983 .

Molecular cluster theory for chemisorption of first row atoms on nickel /100/ surfaces

H. Adachi, D. Ellis, F. W. Averill, 1976 .

Method for calculating molecular Rydberg states

F. W. Averill, T. Walker, J. Waber, 1974 .

Molecular Cluster Study of the Approach of CO to a Ni (100) Surface

H. Adachi, F. W. Averill, D. Pellis, 1974 .

Observations on the Influence of Secondary Me Oxide Additives (Me=Si, Al, Mg) on the Microstructural Evolution and Mechanical Behavior of Silicon Nitride Ceramics Containing RE2O3 (RE=La, Gd, Lu)

N. Shibata, K. Benthem, F. W. Averill, 2010 .

Experimental probe of adsorbate binding energies at internal crystalline/amorphous interfaces in Gd-doped Si3N4

S. Pennycook, K. Benthem, F. W. Averill, 2008 .

Theoretical studies of Ir5Th and Ir5Ce nanoscale precipitates in Ir

James R. Morris, F. W. Averill, V. Cooper, 2014 .

Nanoscale structure in crystalline solid solution alloys

C. J. Sparks, G. Ice, F. W. Averill, 1996 .

Convergence properties of the Harris density functional and the self-consistent atom fragment approximation

F. W. Averill, G. S. Painter, 2006 .

Molecular orbitals of PtF6 and E110 F6 calculated by the self‐consistent multiple scattering Xα method

F. W. Averill, J. Waber, 1974 .

Calculated properties of fully hydrogenated single layers of BN, BC2N, and graphene: Graphane and its BN-containing analogues

Valentino R. Cooper, James R. Morris, F. W. Averill, 2009 .

Orbital forces and chemical bonding in density-functional theory: Application to first-row dimers.

Painter, F. W. Averill, Averill, 1986, Physical review. B, Condensed matter.

Self-consistent one-electron calculation of the zero-temperature cohesive properties of solid argon

F. W. Averill, S. Trickey, F. R. Green, 1972 .

Pair Potentials for van der Waals Solids from a One-Electron Model

F. W. Averill, S. Trickey, F. R. Green, 1974 .

Calculation of the Cohesive Energies and Bulk Properties of the Alkali Metals

F. W. Averill, 1972 .

Bonding in the first-row diatomic molecules within the local spin-density approximation

F. W. Averill, G. S. Painter, Frank W. Averill, 1982 .

One-Electron Theory of the Bulk Properties of Crystalline Ar, Kr, and Xe

F. W. Averill, S. Trickey, F. R. Green, 1973 .