Crystal structure evaluation: calculating relative stabilities and other criteria: general discussion
Matthew A. Addicoat(Nottingham Trent University), Qiang Zhu(University of North Carolina at Charlotte), Samuel Alexander Jobbins, Sarah L. Price(University College London), Jason C. Cole(Cambridge Crystallographic Data Centre), Graeme M. Day(University of Southampton), Sharmarke Mohamed(University of Toronto), Luca Iuzzolino(Merck & Co., Inc., Rahway, NJ, USA (United States)), Julian Helfferich, Marcus A. Neumann, Joost Van Den Ende, David Bowskill(Imperial College London), Alexandre Tkatchenko(University of Luxembourg), Artem R. Oganov(Skolkovo Institute of Science and Technology), Claire S. Adjiman(The London College), Grahame R. Woollam, Gregory J. O. Beran(University of California, Riverside), Ivo B. Rietveld, J. Christian Schön(Max Planck Institute for Solid State Research), John B. O. Mitchell(University of St Andrews), Jonas Nyman(Cambridge Crystallographic Data Centre), Aurora J. Cruz‐Cabeza, Michael T. Ruggiero(University of Vermont), Volker L. Deringer(University of Oxford), Johannes Hoja(University of Graz), Noa Marom(Tulane University), Germán Sastre(Instituto de Tecnología Química), Virginia Burger, Pablo M. Piaggi(University of Illinois Urbana-Champaign), Rui Guo(Pfizer (United States)), Seiji Tsuzuki(National Institute of Advanced Industrial Science and Technology), Jan Gerit Brandenburg(Merck KGaA, Darmstadt (Germany)), David McKay(University of Edinburgh), Doris E. Braun(University College London), Scott M. Woodley(University College London), Susan M. Reutzel‐Edens, Sten Nilsson Lill, Christopher Taylor, Mihails Arhangelskis(University of Warsaw), Alan Hare, Matthew R. Ryder
Cited by 10
Related Papers
Quantum-chemical insights from deep tensor neural networks
|Nature Communications|2017|1.5k
Machine Learning Interatomic Potentials as Emerging Tools for Materials Science
|Advanced Materials|2019|959
Anode-supported intermediate temperature direct internal reforming solid oxide fuel cell. I: model-based steady-state performance
|Journal of Power Sources|2004|747
Report on the sixth blind test of organic crystal structure prediction methods
|Acta Crystallographica Section B Structural Science Crystal Engineering and Materials|2016|606
Anode-supported intermediate-temperature direct internal reforming solid oxide fuel cell
|Journal of Power Sources|2005|347