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Lista de obras de Itai Panas

A mechanistic investigation of ethylene oxide hydrolysis to ethanediol

scientific article published on 29 August 2007

Bridging model and real catalysts: general discussion

scientific article published on 01 July 2016

Catalyst design from theory to practice: general discussion

artículo científico publicado en 2016

Chemical-to-mechanical energy conversion in biomacromolecular machines: a plasmon and optimum control theory for directional work. 1. General considerations

artículo científico publicado en 2008

Communication: Towards catalytic nitric oxide reduction via oligomerization on boron doped graphene.

artículo científico publicado en 2016

Confinement dependence of electro-catalysts for hydrogen evolution from water splitting.

artículo científico publicado en 2014

Electrocatalytic oxygen evolution from water on a Mn(III-V) dimer model catalyst--a DFT perspective

artículo científico publicado en 2011

Hydrolysis on transition metal oxide clusters and the stabilities of M-O-M bridges

artículo científico publicado en 2000

Hydroxide oxidation and peroxide formation at embedded binuclear transition metal sites; TM = Cr, Mn, Fe, Co

artículo científico publicado en 2011

Model studies of the chemisorption of hydrogen and oxygen on Cu(100)

artículo científico publicado en 1987

NO(2) dissociation on Ag(111) revisited by theory

artículo científico publicado en 2008

NOxStorage on BaO(100) Surface from First Principles: a Two Channel Scenario

artículo científico publicado en 2002

Oxygen Vacancy Formation, Mobility, and Hydrogen Pick-up during Oxidation of Zirconium by Water

article

Quantum chemical modeling of ethene epoxidation with hydrogen peroxide: the effect of microsolvation with water

artículo científico publicado en 2007

Quantum chemical modeling of propene and butene epoxidation with hydrogen peroxide.

artículo científico publicado en 2009

Quantum chemical modelling of the rate determining step for oxygen reduction on quinones

scientific article published on 09 August 2006

Single atom hot-spots at Au-Pd nanoalloys for electrocatalytic H2O2 production

artículo científico publicado en 2011

Switching on the electrocatalytic ethene epoxidation on nanocrystalline RuO2

artículo científico publicado en 2011

The bifurcation point of the oxygen reduction reaction on Au-Pd nanoalloys.

artículo científico publicado en 2016

The nature of NOx species on BaO(100): an ab initio molecular dynamics study

artículo científico publicado en 2005

Vibrational motion and geometrical structure in adsorbed CO studied by core level photoelectron spectroscopy

Water adsorption and hydrolysis on molecular transition metal oxides and oxyhydroxides

scientific article published on 01 July 2000

X-ray fluorescence tomography of individual municipal solid waste and biomass fly ash particles.

artículo científico publicado en 2004

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