Lista de obras - Neil J Henson - Dominio Público Uruguay

A Porous Metal−Organic Replica of α-PbO2for Capture of Nerve Agent Surrogate

artículo científico publicado en 2010

A mechanism for the decomposition of dinitropropyl compounds

artículo científico publicado en 2007

Applicability of density functional theory in reproducing accurate vibrational spectra of surface bound species

artículo científico publicado en 2014

Density Functional Theory Study of Degradation of Tetraalkylammonium Hydroxides

artículo científico publicado en 2010

Electric double-layer structure in primitive model electrolytes: comparing molecular dynamics with local-density approximations.

artículo científico publicado en 2015

Electro-reduction of nitrogen on molybdenum nitride: structure, energetics, and vibrational spectra from DFT.

artículo científico publicado en 2014

First-principles prediction of the effects of temperature and solvent selection on the dimerization of benzoic acid.

artículo científico publicado en 2013

ForceFit: a code to fit classical force fields to quantum mechanical potential energy surfaces.

artículo científico publicado en 2010

Importance of out-of-state spin-orbit coupling for slow magnetic relaxation in mononuclear Fe(II) complexes

artículo científico publicado en 2011

In situ X-ray pair distribution function analysis of geopolymer gel nanostructure formation kinetics

artículo científico publicado en 2013

Investigation of formally zerovalent Triphos iron complexes

artículo científico publicado en 2012

Iron Complex-Catalyzed Ammonia–Borane Dehydrogenation. A Potential Route toward B–N-Containing Polymer Motifs Using Earth-Abundant Metal Catalysts

article

Mechanistic aspects of propene epoxidation by hydrogen peroxide. Catalytic role of water molecules, external electric field, and zeolite framework of TS-1.

artículo científico publicado en 2009

Model-free test of local-density mean-field behavior in electric double layers.

artículo científico publicado en 2013

Synthesis, Characterization, and Density Functional Theory Analysis of Uranium and Thorium Complexes Containing Nitrogen-Rich 5-Methyltetrazolate Ligands.

artículo científico publicado en 2016

Unravelling the mechanism of the asymmetric hydrogenation of acetophenone by [RuX2(diphosphine)(1,2-diamine)] catalysts.

artículo científico publicado en 2014

Lista de obras de Neil J Henson

A Porous Metal−Organic Replica of α-PbO2for Capture of Nerve Agent Surrogate

A mechanism for the decomposition of dinitropropyl compounds

Applicability of density functional theory in reproducing accurate vibrational spectra of surface bound species

Density Functional Theory Study of Degradation of Tetraalkylammonium Hydroxides

Electric double-layer structure in primitive model electrolytes: comparing molecular dynamics with local-density approximations.

Electro-reduction of nitrogen on molybdenum nitride: structure, energetics, and vibrational spectra from DFT.

First-principles prediction of the effects of temperature and solvent selection on the dimerization of benzoic acid.

ForceFit: a code to fit classical force fields to quantum mechanical potential energy surfaces.

Importance of out-of-state spin-orbit coupling for slow magnetic relaxation in mononuclear Fe(II) complexes

In situ X-ray pair distribution function analysis of geopolymer gel nanostructure formation kinetics

Investigation of formally zerovalent Triphos iron complexes

Iron Complex-Catalyzed Ammonia–Borane Dehydrogenation. A Potential Route toward B–N-Containing Polymer Motifs Using Earth-Abundant Metal Catalysts

Mechanistic aspects of propene epoxidation by hydrogen peroxide. Catalytic role of water molecules, external electric field, and zeolite framework of TS-1.

Model-free test of local-density mean-field behavior in electric double layers.

Synthesis, Characterization, and Density Functional Theory Analysis of Uranium and Thorium Complexes Containing Nitrogen-Rich 5-Methyltetrazolate Ligands.

Unravelling the mechanism of the asymmetric hydrogenation of acetophenone by [RuX2(diphosphine)(1,2-diamine)] catalysts.