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List of works by Constantinos D Zeinalipour-Yazdi

A Computational Study of the Heterogeneous Synthesis of Hydrazine on Co3Mo3N

scientific article published on 24 May 2017

An experimental and computational IR and hybrid DFT-D3 study of the conformations of l-lactic and acrylic acid: new insight into the dehydration mechanism of lactic acid to acrylic acid

scientific article published on 02 October 2019

CO adsorption over Pd nanoparticles: A general framework for IR simulations on nanoparticles

DFT-D3 study of H2 and N2 chemisorption over cobalt promoted Ta3N5-(100), (010) and (001) surfaces

scientific article published on 25 April 2017

Impact of co-adsorbed oxygen on crotonaldehyde adsorption over gold nanoclusters: a computational study.

scientific article

Mechanisms of ammonia and hydrazine synthesis on η-Mn3N2-(100) surfaces

scientific article published on 28 August 2019

Receptor‐attached amphiphilic terpolymer for selective drug recognition in aqueous solutions ⬇️

scientific article published on 01 July 2011

The integration of experiment and computational modelling in heterogeneously catalysed ammonia synthesis over metal nitrides

scientific article published on 01 August 2018

The sphere-in-contact model of carbon materials

scientific article published on 20 January 2016

Topology of active site geometries in HCP and FCC nanoparticles and surfaces

scientific article published in 2022

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