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Browsing by Subject DFT
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Showing results 1 to 4 of 4
Issue Date
Title
Author(s)
2021
Deep Neural Network Simulations of Bulk and Interfacial Systems
Calegari Andrade, Marcos Felipe
9-Oct-2020
Deep Potential training data for crystalline and disordered TiO2 phases
Calegari Andrade, Marcos
;
Selloni, Annabella
2013
FIRST-PRINCIPLES DENSITY FUNCTIONAL THEORY STUDY OF COBALT (HYDR)OXIDES AND TITANIUM DIOXIDE FOR ELECTROCHEMICAL OXYGEN EVOLUTION
Chen, Jia
2018
Quantum Mechanical Studies of Electrocatalysts for the Hydrogen and Oxygen Evolution Reactions
Tkalych, Alexander