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Lista de obras de Sergey M Kozlov

Approaching complexity of alkyl hydrogenation on Pd via density-functional modelling

artículo científico publicado en 2017

Bandgap engineering of graphene by physisorbed adsorbates

artículo científico publicado en 2011

Bulk Properties of Transition Metals: A Challenge for the Design of Universal Density Functionals

artículo científico publicado en 2014

Counting electrons on supported nanoparticles.

artículo científico publicado en 2015

Direct versus ligand-exchange synthesis of [PtAg28(BDT)12(TPP)4]4- nanoclusters: effect of a single-atom dopant on the optoelectronic and chemical properties

artículo científico publicado en 2017

Doping-Induced Anisotropic Self-Assembly of Silver Icosahedra in [Pt2Ag23Cl7(PPh3)10] Nanoclusters

artículo científico publicado en 2017

Effect of MgO(100) support on structure and properties of Pd and Pt nanoparticles with 49-155 atoms

artículo científico publicado en 2013

Electronic-structure-based material descriptors: (in)dependence on self-interaction and Hartree–Fock exchange

artículo científico publicado en 2015

Establishing the Accuracy of Broadly Used Density Functionals in Describing Bulk Properties of Transition Metals.

artículo científico publicado en 2013

Formation of one-dimensional electronic states along the step edges of CeO₂(111).

artículo científico publicado en 2012

How absorbed hydrogen affects the catalytic activity of transition metals

scientific article published on 07 October 2014

How to determine accurate chemical ordering in several nanometer large bimetallic crystallites from electronic structure calculations.

artículo científico publicado en 2015

O vacancies on steps on the CeO2(111) surface

artículo científico publicado en 2014

Reduced ceria nanofilms from structure prediction

scientific article published on 01 March 2015

Revealing chemical ordering in Pt-Co nanoparticles using electronic structure calculations and X-ray photoelectron spectroscopy

artículo científico publicado en 2015

Roughening of Copper (100) at Elevated CO Pressure: Cu Adatom and Cluster Formation Enable CO Dissociation

artículo científico publicado en 2018

The role of metal/oxide interfaces for long-range metal particle activation during CO oxidation.

artículo científico publicado en 2018

Theoretical assessment of graphene-metal contacts.

artículo científico publicado en 2013

Theoretical study of carbon species on Pd(111): competition between migration of C atoms to the subsurface interlayer and formation of Cn clusters on the surface

scientific article published on 14 October 2009

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