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List of works by John R. Kitchin

Accurate electronic and chemical properties of 3d transition metal oxides using a calculated linear response U and a DFT + U(V) method.

scientific article published in April 2015

Alchemical Predictions for Computational Catalysis: Potential and Limitations

scientific article published on 22 September 2017

An inverse mapping approach for process systems engineering using automatic differentiation and the implicit function theorem

scientific article published in 2023

CO(2) adsorption on supported molecular amidine systems on activated carbon.

scientific article published on August 2010

Configurational correlations in the coverage dependent adsorption energies of oxygen atoms on late transition metal fcc(111) surfaces

scientific article published on 01 March 2011

Effects of strain, d-band filling, and oxidation state on the bulk electronic structure of cubic 3d perovskites

scientific article published on 01 September 2011

Effects of strain, d-band filling, and oxidation state on the surface electronic structure and reactivity of 3d perovskite surfaces ⬇️

scientific article published on August 28, 2012

Electrocatalytic oxygen evolution with an immobilized TAML activator.

scientific article published on 7 April 2014

H3PW12O40-functionalized tip for scanning tunneling microscopy.

scientific article

Identifying potential BO2 oxide polymorphs for epitaxial growth candidates

scientific article published on 6 February 2014

Modification of the surface electronic and chemical properties of Pt(111) by subsurface 3d transition metals

scientific article published in June 2004

Relationships between the surface electronic and chemical properties of doped 4d and 5d late transition metal dioxides.

scientific article published in March 2015

Response to “Comment on ‘Trends in the Exchange Current for Hydrogen Evolution’ [J. Electrochem. Soc., 152, J23 (2005)]”

The outlook for improved carbon capture technology

scholarly article by Edward S. Rubin et al published October 2012 in Progress in Energy and Combustion Science

Trends in the Exchange Current for Hydrogen Evolution

Tuning oxide activity through modification of the crystal and electronic structure: from strain to potential polymorphs

scientific article published on 12 October 2015

Universality in Oxygen Evolution Electrocatalysis on Oxide Surfaces

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