Lista de obras - Michel A Van Hove - Dominio Público Uruguay

A random rotor molecule: Vibrational analysis and molecular dynamics simulations

article

A standard format for reporting atomic positions: Further needs and options

Atomic-scale structure: From surfaces to nanomaterials

Atomistic Simulations of fcc Pt75Ni25 and Pt75Re25 Cubo-octahedral Nanoparticles

CO dissociation on magnetic Fe(n) clusters

artículo científico publicado en 2014

Circular Dichroism inK-Shell Ionization from Fixed-in-Space CO andN2Molecules

artículo científico publicado en 2002

Computational prediction of optimal metal ions to induce coordinated polymerization of muscle-like [c2]daisy chains

artículo científico publicado en 2016

Controlling the Rotational Barrier of Single Porphyrin Rotors on Surfaces

artículo científico publicado en 2020

Cooperative Modulation of Electronic Structures of Aromatic Molecules Coupled to Multiple Metal Contacts

artículo científico publicado en 2013

Differential Photoelectron Holography: A New Approach for Three-Dimensional Atomic Imaging

artículo científico publicado en 2002

Donor/Acceptor Properties of Aromatic Molecules in Complex Metal-Molecule Interfaces

artículo científico publicado en 2016

Efficient calculation of electron diffraction for the structural determination of nanomaterials.

artículo científico publicado en 2006

Electron Stimulation of Internal Torsion of a Surface-Mounted Molecular Rotor

scientific article published on 01 August 2010

Energetics and dynamics of a new type of extended line defects in graphene

artículo científico publicado en 2012

Enhancement of spin polarization induced by Coulomb on-site repulsion between localized pz electrons in graphene embedded with line defects

artículo científico publicado en 2015

Exploring Molecules beyond CO as Tip Functionalizations in High-Resolution Noncontact Atomic Force Microscopy: A First Principles Approach

scientific article published on 21 November 2016

Fragment motion in motor molecules: basic concepts and application to intra-molecular rotations

artículo científico publicado en 2018

From surface science to nanotechnology

Green emission in ZnO nanostructures—Examination of the roles of oxygen and zinc vacancies

article by Y.H. Leung et al published April 2013 in Applied Surface Science

Higher-generation type III-B rotaxane dendrimers with controlling particle size in three-dimensional molecular switching.

artículo científico publicado en 2018

Interlocking Mechanism between Molecular Gears Attached to Surfaces.

artículo científico publicado en 2018

Interlocking Molecular Gear Chains Built on Surfaces.

artículo científico publicado en 2018

Intramolecular Torque Study of a Molecular Rotation Stimulated by Electron Injection and Extraction

scientific article published on 18 September 2018

Intramolecular torque, an indicator of the internal rotation direction of rotor molecules and similar systems ⬇️

artículo científico publicado en 2016

Manipulating Magnetism at Organic/Ferromagnetic Interfaces by Molecule-Induced Surface Reconstruction

artículo científico publicado en 2016

Manipulating localized molecular orbitals by single-atom contacts

artículo científico publicado en 2010

Mechanical properties of solid C60 studied with density functional tight binding method augmented by an empirical dispersion term

artículo científico publicado en 2008

Monte Carlo simulations of segregation in Pt-Ni catalyst nanoparticles

artículo científico publicado en 2005

Monte Carlo simulations of segregation in Pt-Re catalyst nanoparticles

artículo científico publicado en 2004

Novel genetic algorithm search procedure for LEED surface structure determination

artículo científico publicado en 2014

Optimal Electron Doping of aC60Monolayer on Cu(111) via Interface Reconstruction

artículo científico publicado en 2010

Oxygen vacancy diffusion in bare ZnO nanowires

artículo científico publicado en 2014

Prospects for resolving chemical structure by atomic force microscopy: a first-principles study

artículo científico publicado en 2010

Revealing highly unbalanced energy barriers in the extension and contraction of the muscle-like motion of a [c2]daisy chain

scientific article published on 01 July 2015

Scaling behavior of genetic algorithms applied to surface structural determination by LEED

Selective adsorption of L-serine functional groups on the anatase TiO2(101) surface in benthic microbial fuel cells

artículo científico publicado en 2014

Single-Molecule Resolution of an Organometallic Intermediate in a Surface-Supported Ullmann Coupling Reaction

scientific article published on 21 July 2011

Strong slip-induced anomalous enhancement and red-shifts in wide-range optical absorption of graphite under uniaxial pressure

artículo científico publicado en 2014

Substrate mediated stabilization of methylphosphonic acid on ZnO non-polar surfaces'

Surface sensitivity in electron spectroscopy: coherent versus incoherent scattering models

Surface structures of cubo-octahedral Pt-Mo catalyst nanoparticles from Monte Carlo simulations

artículo científico publicado en 2005

TheNISTSurface Structure Database – SSD version 4

scientific article published on 29 May 2002

Lista de obras de Michel A Van Hove

A random rotor molecule: Vibrational analysis and molecular dynamics simulations

A standard format for reporting atomic positions: Further needs and options

Atomic-scale structure: From surfaces to nanomaterials

Atomistic Simulations of fcc Pt75Ni25 and Pt75Re25 Cubo-octahedral Nanoparticles

CO dissociation on magnetic Fe(n) clusters

Circular Dichroism inK-Shell Ionization from Fixed-in-Space CO andN2Molecules

Computational prediction of optimal metal ions to induce coordinated polymerization of muscle-like [c2]daisy chains

Controlling the Rotational Barrier of Single Porphyrin Rotors on Surfaces

Cooperative Modulation of Electronic Structures of Aromatic Molecules Coupled to Multiple Metal Contacts

Differential Photoelectron Holography: A New Approach for Three-Dimensional Atomic Imaging

Donor/Acceptor Properties of Aromatic Molecules in Complex Metal-Molecule Interfaces

Efficient calculation of electron diffraction for the structural determination of nanomaterials.

Electron Stimulation of Internal Torsion of a Surface-Mounted Molecular Rotor

Energetics and dynamics of a new type of extended line defects in graphene

Enhancement of spin polarization induced by Coulomb on-site repulsion between localized pz electrons in graphene embedded with line defects

Exploring Molecules beyond CO as Tip Functionalizations in High-Resolution Noncontact Atomic Force Microscopy: A First Principles Approach

Fragment motion in motor molecules: basic concepts and application to intra-molecular rotations

From surface science to nanotechnology

Green emission in ZnO nanostructures—Examination of the roles of oxygen and zinc vacancies

Higher-generation type III-B rotaxane dendrimers with controlling particle size in three-dimensional molecular switching.

Interlocking Mechanism between Molecular Gears Attached to Surfaces.

Interlocking Molecular Gear Chains Built on Surfaces.

Intramolecular Torque Study of a Molecular Rotation Stimulated by Electron Injection and Extraction

Intramolecular torque, an indicator of the internal rotation direction of rotor molecules and similar systems ⬇️

Manipulating Magnetism at Organic/Ferromagnetic Interfaces by Molecule-Induced Surface Reconstruction

Manipulating localized molecular orbitals by single-atom contacts

Mechanical properties of solid C60 studied with density functional tight binding method augmented by an empirical dispersion term

Monte Carlo simulations of segregation in Pt-Ni catalyst nanoparticles

Monte Carlo simulations of segregation in Pt-Re catalyst nanoparticles

Novel genetic algorithm search procedure for LEED surface structure determination

Optimal Electron Doping of aC60Monolayer on Cu(111) via Interface Reconstruction

Oxygen vacancy diffusion in bare ZnO nanowires

Prospects for resolving chemical structure by atomic force microscopy: a first-principles study

Revealing highly unbalanced energy barriers in the extension and contraction of the muscle-like motion of a [c2]daisy chain

Scaling behavior of genetic algorithms applied to surface structural determination by LEED

Selective adsorption of L-serine functional groups on the anatase TiO2(101) surface in benthic microbial fuel cells

Single-Molecule Resolution of an Organometallic Intermediate in a Surface-Supported Ullmann Coupling Reaction

Strong slip-induced anomalous enhancement and red-shifts in wide-range optical absorption of graphite under uniaxial pressure

Substrate mediated stabilization of methylphosphonic acid on ZnO non-polar surfaces'

Surface sensitivity in electron spectroscopy: coherent versus incoherent scattering models

Surface structures of cubo-octahedral Pt-Mo catalyst nanoparticles from Monte Carlo simulations

TheNISTSurface Structure Database – SSD version 4

Thermally activated transformation of the adsorption configurations of a complex molecule on a Cu(111) surface

X-ray photoelectron diffraction study of Cu(111): Multiple scattering investigation