C. Richard A. Catlow - researchr alias

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Viewing Publication 1 - 9 from 9

2022

A Workflow Demonstrator for Processing Catalysis Research DataAbraham Nieva de la Hidalga, Donato Decarolis, Shaojun Xu, Santhosh Matam, Willinton Yesid Hernández Enciso, Josephine Goodall, Brian Matthews, C. Richard A. Catlow. dint, 4(2):455-470, 2022. [doi]

2014

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 compoundsJ. Buckeridge, D. O. Scanlon, Aron Walsh, C. Richard A. Catlow. cphysics, 185(1):330-338, 2014. [doi]

2012

Introducing k-point parallelism into VASPAsimina Maniopoulou, Erlend R. M. Davidson, Ricardo Grau-Crespo, Aron Walsh, Ian J. Bush, C. Richard A. Catlow, Scott M. Woodley. cphysics, 183(8):1696-1701, 2012. [doi]

2008

Zinc oxide: A case study in contemporary computational solid state chemistryC. Richard A. Catlow, Samuel A. French, Alexey A. Sokol, Abdullah A. Al-Sunaidi, Scott M. Woodley. jcc, 29(13):2234-2249, 2008. [doi]

2006

2000

Relationship of Crystal Structure to Interionic Interactions in the Lithium-manganese Spinel OxidesPawel Adam Piszora, C. Richard A. Catlow, Scott M. Woodley, Emilia Wolska. CANDC, 24(5):609-613, 2000. [doi]

Structure Refinement of Quaternary Spinel Oxides - Experiments and ModellingEmilia Wolska, C. Richard A. Catlow, Pawel Adam Piszora, Scott M. Woodley. CANDC, 24(5):603-607, 2000. [doi]

1995

The Relaxation of Molecular Crystal Structures Using a Distributed Multipole Electrostatic ModelDavid J. Willock, Sally L. Price, Maurice Leslie, C. Richard A. Catlow. jcc, 16(5):628-647, 1995.

1988

Strategies for modelling of catalystsC. Richard A. Catlow. jcamd, 2(3):255-258, 1988. [doi]

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