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Energy loss and surface temperature effects in ab initio molecular dynamics simulations: N adsorption on Ag(111) as a case study

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The authors acknowledge financial support by the Gobierno Vasco-UPV/EHU Project No. IT756-13 and the Spanish Ministerio de Economia y Competitividad (Grant No. FIS2013-48286-C02-02-P). M.A. and J.I.J. also acknowledge the Spanish… Click to show full abstract

The authors acknowledge financial support by the Gobierno Vasco-UPV/EHU Project No. IT756-13 and the Spanish Ministerio de Economia y Competitividad (Grant No. FIS2013-48286-C02-02-P). M.A. and J.I.J. also acknowledge the Spanish Ministerio de Economia, Industria y Competitividad Grant No. FIS2016-76471-P.

Keywords: effects initio; energy loss; surface temperature; loss surface; temperature effects; initio molecular

Journal Title: Physical Review B
Year Published: 2017

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