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(1) Gates Cambridge Trust, University of Cambridge, UK(2) EPSRC Centre for Doctoral Training in Computational Methods for Materials Science, UK, Grant No. EP/L015552/1.(3) Winton Programme for the Physics of Sustainability, University of Cambridge, UK(4) Sims Fund, University of Cambridge, UK(5) EPSRC Grant No. EP/P003532/1(6) EPSRC Collaborative Computational Projects on the Electronic Structure of Condensed Matter (CCP9), Grant No. EP/M022595/1, and NMR crystallography, Grant No. EP/M022501/1(7) Computing resources on the Tier 1 resource ARCHER were provided through the UKCP EPSRC High-End computational consortium (EP/P022561/1) and on the Tier 2 resources HPC Midlands+ (EP/P020232/1) and CSD3 (EP/P020259/1).

johnson matthey technology review

<i>Ab initio</i> Structure Prediction Methods for Battery Materials : A review of recent computational efforts to predict the atomic level structure and bonding in materials for rechargeable batteries

Ab initio Structure Prediction Methods for Battery Materials : A review of recent computational efforts to predict the atomic level structure and bonding in materials for rechargeable batteries