C. Richard A. Catlow

Publication Activity (10 Years)

Years Active: 1988-2022
Publications (10 Years): 1

Top Topics

Chemical Compounds

Experimental Data

Central Processor

Potential Functions

Top Venues

Comput. Phys. Commun.

Publications

Abraham Nieva de la Hidalga, Donato Decarolis, Shaojun Xu, Santhosh Matam, Willinton Yesid Hernández Enciso, Josephine Goodall, Brian Matthews, C. Richard A. Catlow
A Workflow Demonstrator for Processing Catalysis Research Data. Data Intell. 4 (2) (2022)
John Buckeridge, David O. Scanlon, Aron Walsh, C. Richard A. Catlow
Automated procedure to determine the thermodynamic stability of a material and the range of chemical potentials necessary for its formation relative to competing phases and compounds. Comput. Phys. Commun. 185 (1) (2014)
Asimina Maniopoulou, Erlend R. M. Davidson, Ricardo Grau-Crespo, Aron Walsh, Ian J. Bush, C. Richard A. Catlow, Scott M. Woodley
Introducing k-point parallelism into VASP. Comput. Phys. Commun. 183 (8) (2012)
C. Richard A. Catlow, Samuel A. French, Alexey A. Sokol, Abdullah A. Al-Sunaidi, Scott M. Woodley
Zinc oxide: A case study in contemporary computational solid state chemistry. J. Comput. Chem. 29 (13) (2008)
Martin T. Dove, Toby O. H. White, Andrew M. Walker, Richard Paul Bruin, Kat F. Austen, Emilio Artacho, L. A. Sullivan, Mark Calleja, Matthew G. Tucker, Rik P. Tyer, Philip A. Couch, Kerstin Kleese van Dam, R. J. Allan, Ilian T. Todorov, Clovis Chapman, Wolfgang Emmerich, Arnaud Marmier, Steve C. Parker, M. O. Blanchard, C. Richard A. Catlow, Z. Du, N. de Leeuw, Gareth J. Lewis, Vassil N. Alexandrov, M. Alfredsson, J. P. Brodholt, Peter Murray-Rust
Computational Grids for Mid-Sized Collaborative Projects: The eMinerals Experience. e-Science (2006)
Emilia Wolska, C. Richard A. Catlow, Pawel Adam Piszora, Scott M. Woodley
Structure Refinement of Quaternary Spinel Oxides - Experiments and Modelling. Comput. Chem. 24 (5) (2000)
Pawel Adam Piszora, C. Richard A. Catlow, Scott M. Woodley, Emilia Wolska
Relationship of Crystal Structure to Interionic Interactions in the Lithium-manganese Spinel Oxides. Comput. Chem. 24 (5) (2000)
David J. Willock, Sally L. Price, Maurice Leslie, C. Richard A. Catlow
The Relaxation of Molecular Crystal Structures Using a Distributed Multipole Electrostatic Model. J. Comput. Chem. 16 (5) (1995)
C. Richard A. Catlow
Strategies for modelling of catalysts. J. Comput. Aided Mol. Des. 2 (3) (1988)