Tight-binding theory of chemisorption: CO on Ni(100) and (111)

An Extended Hückel Theory. I. Hydrocarbons

1963 • 4,551 citations

Atomic Structure Calculations

1964 • 4,027 citations

Approximate molecular orbital theory

1970 • 3,604 citations

Special Points in the Brillouin Zone

1973 • 1,968 citations

Molecular photoelectron spectroscopy

1972 • 716 citations

A Discussion on photoelectron spectroscopy - Molecular photoelectron spectroscopy

1970 • 592 citations

Structural Influences on Adsorption Energy. II. CO on Ni(100)

1972 • 517 citations

Adsorption of CO on a Ni(111) surface

1974 • 356 citations

Photoemission Energy-Level Measurements of Chemisorbed CO and O on Ni

1971 • 354 citations

Molecular-orbital studies of transition- and noble-metal clusters by the self-consistent-field-<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mi>X</mml:mi><mml:mi>α</mml:mi></mml:math>scattered-wave method

1976 • 345 citations

Theory of carbon monoxide chemisorption on transition metals

1974 • 273 citations

Electronic Structure of<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi mathvariant="normal">Hg</mml:mi></mml:mrow><mml:mrow><mml:mn>1</mml:mn><mml:mo>−</mml:mo><mml:mi>x</mml:mi></mml:mrow></mml:msub></mml:mrow><mml:mrow><mml:msub><mml:mrow><mml:mi mathvariant="normal">Cd</mml:mi></mml:mrow><mml:mrow><mml:mi>x</mml:mi></mml:mrow></mml:msub></mml:mrow><mml:mi mathvariant="normal">Te</mml:mi></mml:math>Alloys and Charge-Density …

1973 • 216 citations

Surface densities of states in the tight-binding approximation

1973 • 173 citations

Localized Orbitals for Molecular Quantum Theory. I. The Hückel Theory

1969 • 167 citations

Interpretation of the photoelectron spectra of molecularly adsorbed CO

1975 • 157 citations

Surface densities of states in cleaved transition metals

1975 • 147 citations

Molecular orbital investigation of chemisorption. I. Hydrogen on tungsten (100) surface

1973 • 140 citations

A chemical pseudopotential approach to covalent bonding. I

1975 • 137 citations

LCAO studies of hydrogen chemisorption on nickel

1976 • 127 citations

CNDO model and interpretation of the photoelectron spectrum of CO chemisorbed on Ni

1974 • 126 citations

Interpretation of the photoemission spectrum of chemisorbed carbon monoxide on Ni (100)

1975 • 125 citations

A molecular orbital approach to chemisorption

1971 • 119 citations

Chemisorption theory in the Hartree-Fock approximation

1974 • 114 citations

Photoemission Studies of Inorganic (CO, O, NO) and Organic (C₂H₂, C₂H₄, C₆H₆) Adsorbates on Ni(111) and Surface Reactions

1974 • 104 citations

Crystal field surface orbital — Bond-energy bond- order (CFSO-BEBO) model for chemisorption: Application to hydrogen adsorption on a platinum (111) surface

1972 • 94 citations

Induced covalent bond theory of chemisorption

1975 • 72 citations

LCAO studies of hydrogen chemisorption on nickel

1976 • 69 citations

Electronic energy level structure calculations of chemisorbed CO on Ni (100)

1975 • 68 citations

Adsorption and oxidation of carbon monoxide on {100} nickel

1968 • 63 citations

Adsorption and Oxidation of Carbon Monoxide on (100) Nickel

1965 • 62 citations

Crystal field surface orbital-bond energy bond order (CFSO-BEBO) calculations of adsorption

1973 • 57 citations

A comparison of SCF-Xα and extended Hückel methods for metal clusters

1975 • 41 citations

Electronic structures of layer and chain elements by a local orbital method

1975 • 36 citations

Adsorption of CO on clean {100} nickel

1968 • 10 citations