Understanding the Pressure Effect on the Elastic, Electronic, Vibrational, and Bonding Properties of the CeScO3 Perovskite

D.E. acknowledges the financial support given by the Spanish Ministry of Science, Innovation, and Universities (MCIU) under grant nos. PID2019-106383GB-C41 and RED2018-102612-T (MALTA Consolider-Team network) and by Generalitat Valenciana under Grant Prometeo/2018/123 (EFIMAT). R.F. and A. Lobato are grateful to financial support from Spanish MCIU under grant PGC2018-094814-B-C22. We would like to thank TGCC under the allocation 2020-A0080910433 made by GENCI, the PMMS (Pôle Messin de Modélisation et de Simulation), the Tirant supercomputer (Universitat de Valencia), and the MALTA-Consolider facilities for providing us the computational resources. S.G. and M.B. also acknowledge financial support through the COMETE project (Conception in silico de Matériaux pour l’Environnement et l’Energie) co-funded by the European Union under the program “FEDERFSE Lorraine et Massif des Vosges 2014–2020”.