Lista de obras - Donald R. Hamann - Dominio Público Uruguay

ABINIT: First-principles approach to material and nanosystem properties

article by Xavier Gonze et al published December 2009 in Computer Physics Communications

ABINIT: Overview and focus on selected capabilities

scientific article published on 01 March 2020

Absolute and approximate calculations of electron-energy-loss spectroscopy edge thresholds

scientific article published on 03 September 2002

Analysis of CO-Cu bonding by observation of interface states on Cu/Ru bimetallic surfaces

Anharmonic vibrational modes of chemisorbed H on the Rh(001) surface

article

Application of adaptive curvilinear coordinates to the electronic structure of solids

artículo científico publicado en 1995

Ballistic electron transmission through interfaces

artículo científico publicado en 1988

Band structure and semiconducting properties of FeSi

scientific article published on 01 May 1993

Band structure in adaptive curvilinear coordinates

artículo científico publicado en 1995

Bonding geometry and H vibrations on W(001)

artículo científico publicado en 1986

Compton scattering evidence for covalency of the hydrogen bond in ice

article

Covalency of the Hydrogen Bond in Ice: A Direct X-Ray Measurement

artículo científico publicado en 1999

Diffusive behavior of states in the Hubbard-Stratonovitch transformation

scientific article published on 01 January 1991

Direct fabrication of large micropatterned single crystals

artículo científico publicado en 2003

Electron transmission through NiSi2-Si interfaces

artículo científico publicado en 1989

Electron transmission through silicon stacking faults

artículo científico publicado en 1990

Electronic Structure of a "Poisoned" Transition-Metal Surface

artículo científico publicado en 1984

Electronic and structural properties ofCaSi2

artículo científico publicado en 1990

Electronic band properties of Ba2Tl

artículo científico publicado en 1988

Electronic band properties of CaSr2Bi

artículo científico publicado en 1988

Electronic band properties of Pb2Sr2YCu3O8

artículo científico publicado en 1989

Electronic properties of zircon and hafnon from many-body perturbation theory

scholarly article in Physical Review B, vol. 79 no. 19, May 2009

Electronic structure and properties of CoSi2

artículo científico publicado en 1988

Electronic structure of a Ti(0001) film

scholarly article in Physical Review B, vol. 20 no. 4, August 1979

Electronic structure of metal overlayers on rhodium

scholarly article by Peter J. Feibelman & Donald R. Hamann published 15 September 1983 in Physical Review B

Electronic structure of the high-Tc superconductor Ba1-xKxBiO3

scientific article published on 01 June 1988

Energetics of silicide interface formation

artículo científico publicado en 1985

Energy measurement in auxiliary-field many-electron calculations

artículo científico publicado en 1990

Generalized gradient theory for silica phase transitions

scientific article published on 01 January 1996

Generalized norm-conserving pseudopotentials

artículo científico publicado en 1989

Generalized-gradient functionals in adaptive curvilinear coordinates

artículo científico publicado en 1996

Geometric vs. electronic factor in surface electronic structure-H adsorption on Sc and Ti(0001)

H 2 O hydrogen bonding in density-functional theory

artículo científico publicado en 1997

He-Si(100) potential: Charge superposition and model structures

artículo científico publicado en 1986

Interatomic potentials for silicon structural energies

scientific article published on 01 November 1985

Interface-state properties for strained-layer Ni adsorbed on Ru(0001)

artículo científico publicado en 1988

LAPW calculations of Rh(001) surface relaxation

Linear augmented-plane-wave calculation of the structural properties of bulk Cr, Mo, and W

artículo científico publicado en 1986

Long-range interactions in auxiliary-field many-electron calculations

artículo científico publicado en 1993

Modification of Cu-H bonding near a Ru(0001) surface

Modification of transition metal electronic structure by P, S, Cl, and Li adatoms

New classical models for silicon structural energies

artículo científico publicado en 1987

New silicide interface model from structural energy calculations

artículo científico publicado en 1988

Norm-Conserving Pseudopotentials

artículo científico publicado en 1979

Observation of a true interface state in strained-layer Cu adsorption on Ru(0001)

scientific article published in Physical Review Letters

Optimized norm-conserving Vanderbilt pseudopotentials

scholarly article in Physical Review B, vol. 88 no. 8, August 2013

Oxygen hole symmetry and banding in cuprate superconductors

artículo científico publicado en 1989

Positive-projection Monte Carlo simulation: A new variational approach to strongly interacting fermion systems

artículo científico publicado en 1990

Pseudopotentials that work: From H to Pu

artículo científico publicado en 1982

Quantum-size effects in work functions of free-standing and adsorbed thin metal films

scholarly article in Physical Review B, vol. 29 no. 12, June 1984

Real-space observation of surface states on Si(111)7 x 7 with the tunneling microscope

artículo científico publicado en 1985

Recent developments in the ABINIT software package

Reply to "Comment on 'Pseudopotentials that work: From H to Pu' "

artículo científico publicado en 1988

Reproducibility in density functional theory calculations of solids

artículo científico publicado en 2016

Sensitivity of helium diffraction to surface geometry

artículo científico publicado en 1985

Simulated annealing of silicon atom clusters in Langevin molecular dynamics

artículo científico publicado en 1986

Site and nature of H bonding on Ti (0001)

scholarly article in Physical Review B, vol. 22 no. 4, August 1980

Spectroscopic determination of surface geometry: Ti(0001)-H(1×1)

scholarly article in Physical Review B, vol. 21 no. 4, February 1980

Structural calculations for bulk As

artículo científico publicado en 1986

Summary Abstract: Studies of the interaction of CO with the interface states for strained‐layer Cu on Ru(0001)

Surface and interface properties for the Cu/W(110) system and their effect on oxygen adsorption

scientific article published on 01 January 1992

Surface states of Sc(0001) and Ti(0001)

Surface states of clean and metal-overlayer-covered Cr(001) films

artículo científico publicado en 1985

Surface structure of Ge(100) studied by He diffraction

artículo científico publicado en 1987

The PseudoDojo : Training and grading a 85 element optimized norm-conserving pseudopotential table

article by Michiel J van Setten et al published May 2018 in Computer Physics Communications

Theory and Application for the Scanning Tunneling Microscope

artículo científico publicado en 1983

Theory of H bonding and vibration on Pt(111)

article

Theory of H bonding and vibration on Ru(0001)

article

Theory of H bonding and vibration on close‐packed metal surfaces

article

Theory of H-bonding to a pseudomorphic monolayer of Ni on a W(001) surface

Theory of ballistic-electron-emission spectroscopy of NiSi2/Si(111) interfaces

scientific article published on 01 June 1991

Theory of the scanning tunneling microscope

artículo científico publicado en 1985

Transition from chaotic to nonchaotic behavior in randomly driven systems

scientific article published on 01 August 1992

Lista de obras de Donald R. Hamann

ABINIT: First-principles approach to material and nanosystem properties

ABINIT: Overview and focus on selected capabilities

Absolute and approximate calculations of electron-energy-loss spectroscopy edge thresholds

Analysis of CO-Cu bonding by observation of interface states on Cu/Ru bimetallic surfaces

Anharmonic vibrational modes of chemisorbed H on the Rh(001) surface

Application of adaptive curvilinear coordinates to the electronic structure of solids

Ballistic electron transmission through interfaces

Band structure and semiconducting properties of FeSi

Band structure in adaptive curvilinear coordinates

Bonding geometry and H vibrations on W(001)

Compton scattering evidence for covalency of the hydrogen bond in ice

Covalency of the Hydrogen Bond in Ice: A Direct X-Ray Measurement

Diffusive behavior of states in the Hubbard-Stratonovitch transformation

Direct fabrication of large micropatterned single crystals

Electron transmission through NiSi2-Si interfaces

Electron transmission through silicon stacking faults

Electronic Structure of a "Poisoned" Transition-Metal Surface

Electronic and structural properties ofCaSi2

Electronic band properties of Ba2Tl

Electronic band properties of CaSr2Bi

Electronic band properties of Pb2Sr2YCu3O8

Electronic properties of zircon and hafnon from many-body perturbation theory

Electronic structure and properties of CoSi2

Electronic structure of a Ti(0001) film

Electronic structure of metal overlayers on rhodium

Electronic structure of the high-Tc superconductor Ba1-xKxBiO3

Energetics of silicide interface formation

Energy measurement in auxiliary-field many-electron calculations

Generalized gradient theory for silica phase transitions

Generalized norm-conserving pseudopotentials

Generalized-gradient functionals in adaptive curvilinear coordinates

Geometric vs. electronic factor in surface electronic structure-H adsorption on Sc and Ti(0001)

H 2 O hydrogen bonding in density-functional theory

He-Si(100) potential: Charge superposition and model structures

Interatomic potentials for silicon structural energies

Interface-state properties for strained-layer Ni adsorbed on Ru(0001)

LAPW calculations of Rh(001) surface relaxation

Linear augmented-plane-wave calculation of the structural properties of bulk Cr, Mo, and W

Long-range interactions in auxiliary-field many-electron calculations

Modification of Cu-H bonding near a Ru(0001) surface

Modification of transition metal electronic structure by P, S, Cl, and Li adatoms

New classical models for silicon structural energies

New silicide interface model from structural energy calculations

Norm-Conserving Pseudopotentials

Observation of a true interface state in strained-layer Cu adsorption on Ru(0001)

Optimized norm-conserving Vanderbilt pseudopotentials

Oxygen hole symmetry and banding in cuprate superconductors

Positive-projection Monte Carlo simulation: A new variational approach to strongly interacting fermion systems

Pseudopotentials that work: From H to Pu

Quantum-size effects in work functions of free-standing and adsorbed thin metal films

Real-space observation of surface states on Si(111)7 x 7 with the tunneling microscope

Recent developments in the ABINIT software package

Reply to "Comment on 'Pseudopotentials that work: From H to Pu' "

Reproducibility in density functional theory calculations of solids

Sensitivity of helium diffraction to surface geometry

Simulated annealing of silicon atom clusters in Langevin molecular dynamics

Site and nature of H bonding on Ti (0001)

Spectroscopic determination of surface geometry: Ti(0001)-H(1×1)

Structural calculations for bulk As

Summary Abstract: Studies of the interaction of CO with the interface states for strained‐layer Cu on Ru(0001)

Surface and interface properties for the Cu/W(110) system and their effect on oxygen adsorption

Surface states of Sc(0001) and Ti(0001)

Surface states of clean and metal-overlayer-covered Cr(001) films

Surface structure of Ge(100) studied by He diffraction

The PseudoDojo : Training and grading a 85 element optimized norm-conserving pseudopotential table

Theory and Application for the Scanning Tunneling Microscope

Theory of H bonding and vibration on Pt(111)

Theory of H bonding and vibration on Ru(0001)

Theory of H bonding and vibration on close‐packed metal surfaces

Theory of H-bonding to a pseudomorphic monolayer of Ni on a W(001) surface

Theory of ballistic-electron-emission spectroscopy of NiSi2/Si(111) interfaces

Theory of the scanning tunneling microscope

Transition from chaotic to nonchaotic behavior in randomly driven systems