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Juan A Santana

Juan A Santana

Universidad de Puerto Rico - Rawalakot / Puerto Rico
Natural Sciences / Chemical Sciences
AD Scientific Index ID: 807350
University of Puerto Rico
person_outline Juan A Santana's MOST POPULAR ARTICLES
1-) Pseudopotentials for quantum Monte Carlo studies of transition metal oxides Physical Review B 93 (7), 075143, 2016
2-) Structural stability and defect energetics of ZnO from diffusion quantum Monte Carlo The Journal of chemical physics 142 (16), 164705, 2015
3-) Electrochemical hydrogen oxidation on Pt (110): a combined direct molecular dynamics/density functional theory study The Journal of Physical Chemistry C 114 (11), 4995-5002, 2010
4-) DFT and thermodynamics calculations of surface cation release in LiCoO2 Applied surface science 515, 145865, 2020
5-) Many-body ab initio diffusion quantum Monte Carlo applied to the strongly correlated oxide NiO The Journal of Chemical Physics 143 (16), 2015