The Minnesota Density Functionals and their Applications to Problems in Mineralogy and Geochemistry
about
Computational electrochemistry: prediction of liquid-phase reduction potentials.Conversion of CO2 and C2H6 to propanoic acid over a Au-exchanged MCM-22 zeolite.Iridium Complexes with Proton-Responsive Azole-Type Ligands as Effective Catalysts for CO2 Hydrogenation.Experimental and quantum chemical characterization of the water oxidation cycle catalysed by [RuII(damp)(bpy)(H2O)]2+Quantum chemical characterization of the mechanism of an iron-based water oxidation catalystFree energy of reaction by density functional theory: oxidative addition of ammonia by an iridium complex with PCP pincer ligandsDensity functional study of multiplicity-changing valence and Rydberg excitations of p-block elements: Delta self-consistent field, collinear spin-flip time-dependent density functional theory (DFT), and conventional time-dependent DFT
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P2860
The Minnesota Density Functionals and their Applications to Problems in Mineralogy and Geochemistry
description
im Januar 2010 veröffentlichter wissenschaftlicher Artikel
@de
wetenschappelijk artikel
@nl
наукова стаття, опублікована в січні 2010
@uk
name
The Minnesota Density Function ...... in Mineralogy and Geochemistry
@en
The Minnesota Density Function ...... in Mineralogy and Geochemistry
@nl
type
label
The Minnesota Density Function ...... in Mineralogy and Geochemistry
@en
The Minnesota Density Function ...... in Mineralogy and Geochemistry
@nl
prefLabel
The Minnesota Density Function ...... in Mineralogy and Geochemistry
@en
The Minnesota Density Function ...... in Mineralogy and Geochemistry
@nl
P356
P1476
The Minnesota Density Function ...... in Mineralogy and Geochemistry
@en
P2093
D. G. Truhlar
P356
10.2138/RMG.2010.71.2
P577
2010-01-01T00:00:00Z