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Rafael Costa-Amaral
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The influence of hydroxy groups on the adsorption of three-carbon alcohols on Ni (111), Pd (111) and Pt (111) surfaces: a density functional theory study within the D3 …
PCD Mendes, R Costa-Amaral, JF Gomes, JLF Da Silva
Physical Chemistry Chemical Physics 21 (16), 8434-8444, 2019
242019
Unveiling the adsorption properties of 3d, 4d, and 5d metal adatoms on the MoS2 monolayer: A DFT-D3 investigation
R Costa-Amaral, A Forhat, NAMS Caturello, JLF Da Silva
Surface Science 701, 121700, 2020
202020
The adsorption of alcohols on strained Pt3Ni(111) substrates: a density functional investigation within the D3 van der Waals correction
RC Amaral, JLF Da Silva
Physical Chemistry Chemical Physics, 2018
182018
The Role of Low-Coordinated Sites on the Adsorption of Glycerol on Defected Ptn/Pt(111) Substrates: A Density Functional Investigation within the D3 van der …
RC Amaral, P Tereshchuk, Y Seminovski, JLF Da Silva
The Journal of Physical Chemistry C 121 (6), 3445-3454, 2017
162017
First-principles study of the adsorption of 3d transition metals on BaO-and TiO2-terminated cubic-phase BaTiO3 (001) surfaces
R Costa-Amaral, Y Gohda
The Journal of Chemical Physics 152 (20), 2020
102020
Ab initio investigation of the formation of ZrO2-like structures upon the adsorption of Zrn on the CeO2 (111) surface
J Mucelini, R Costa-Amaral, Y Seminovski, JLF Da Silva
The Journal of Chemical Physics 149 (24), 2018
102018
Glycerol adsorption on a defected Pt 6/Pt (100) substrate: a density functional theory investigation within the D3 van der Waals correction
P Tereshchuk, RC Amaral, Y Seminovski, JLF Da Silva
RSC advances 7 (28), 17122-17127, 2017
92017
The role of the anionic and cationic pt sites in the adsorption site preference of water and ethanol on defected Pt4/Pt (111) substrates: A density functional theory …
Y Seminovski, RC Amaral, P Tereshchuk, JLF Da Silva
Surface Science 667, 84-91, 2018
82018
Role of Ferroelectricity, Delocalization, and Occupancy of States in the Electrical Control of Interface-Induced Magnetization
R Costa-Amaral, Y Gohda
Physical Review Applied 15 (6), 064014, 2021
72021
Origin of anisotropic magnetoresistance tunable with electric field in Co2FeSi/BaTiO3 multiferroic interfaces
S Tsuna, R Costa-Amaral, Y Gohda
Journal of Applied Physics 132 (23), 2022
32022
Accurate atomic electron affinities calculated by using anionic Gaussian basis sets
R Costa-Amaral, ACM Tello, M Comar, ABF da Silva
Theoretical Chemistry Accounts 139, 1-8, 2020
12020
Estudo ab initio da adsorção de metanol, etanol e glicerol sobre superfícies de platina com defeitos e ligas de Pt3Ni com tensões
RC Amaral
Universidade de São Paulo, 2019
2019
From Bulk CeO2 to Transition-Metal Clusters Supported on the CeO2(111) Surface: A Critical Discussion
RC Amaral, J Mucelini, Y Seminovski, JLF Da Silva
Encyclopedia of Interfacial Chemistry: Reference Module in Chemistry …, 2018
2018
Investigação químico-quântico da preferência de adsorção de METAIS DE transição 3d, 4d E 5d em uma monocamada de mos2 (0001)
A Forhat, RC Amaral, JLF Silva
Resumos, 2018
2018
From bulk Ce O2 to transition-metal clusters supported on the CeO2 (111) surface
RC Amaral, J Mucelini, Y Seminovski, JLF Silva
Encyclopedia of Interfacial Chemistry: Surface Science and Electrochemistry, 2017
2017
Ivestigação químico-quântico das propriedades estruturais e eletronicas de materiais em camada: o exemplo do MOS2
A Forhat, JLF Silva, RC Amaral
Anais, 2017
2017
Uma nova estratégia para o cálculo de afinidades eletrônicas
RC Amaral
Universidade de São Paulo, 2015
2015
Jatropha Oil Transesterification and Byproducts
RS da Cruz, IP Lôbo, JFS de Carvalho Filho, RC Amaral, FO Souza
Jatropha, Challenges for a New Energy Crop: Volume 1: Farming, Economics and …, 2012
2012
The Role of Low-Coordinated Sites on the Adsorption of Glycerol on Defected Pt
RC Amaral, P Tereshchuk, Y Seminovski, JLF Da Silva
Ab Initio Investigation of Methanol Adsorption on Pt 3 Ni (111)-Based Substrates
R Costa-Amaral, JLF Da Silva
Center for Innovation on New Energies, 9, 0
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