Thermodynamics of zinc insertion in CuGaS2:Ti, used as a modulator agent in an intermediate-band photovoltaic material
Y. Seminóvski , P. Palacios , J.C. Conesa , P. Wahnón
Computational and Theoretical Chemistry 975 134 -137
11
2011
From bulk Ce O2 to transition-metal clusters supported on the CeO2 (111) surface
RC Amaral , J Mucelini , Y Seminovski , Juarez Lopes Ferreira da Silva
Encyclopedia of Interfacial Chemistry: Surface Science and Electrochemistry
2017
First Principles study of Bi doped CdTe thin film solar cells: electronic and optical properties
Y Seminóvskia
TNA POSTERS (11) 17 -17
Ab-Initio calculations including Van der Waals interactions: the SnS2 layered material.
Y Seminóvski , P Palacios , R Grau-Crespo , P Wahnón
New generation of materials for more efficient solar energy use: Quantum modelling and experimental realizations
Irene Aguilera , Raquel Lucena , Perla Wahnón Banarroch , Yohanna Seminovski
Recent advances within the field of materials science in Spain, 2015, ISBN 978-84-9717-346-9, págs. 30-43 30 -43
2015
Water adsorption on Pt(111), Pt4/Pt(111), CeO2(111) and pt4/CeO2(111) substrates
Polina Tereshchuk , Juarez Lopes Ferreira da Silva , Yohanna Seminovski , Adam Keijna
Livro de resumos
2015
Separation of an aqueous mixture of 6-kestose/sucrose with zeolites: A molecular dynamics simulation
Julio Polaina , German Sastre , Alechania Misturini , Yohanna Seminovski
Microporous and Mesoporous Materials 319 111031
1
2021
Glycerol adsorption on a defected Pt6/Pt(100) substrate: a density functional theory investigation within the D3 van der Waals correction
Polina Tereshchuk , Rafael C Amaral , Yohanna Seminovski , Juarez LF Da Silva
RSC Advances 7 ( 28) 17122 -17127
2
2017
Ab initio investigation of the formation of ZrO2-like structures upon the adsorption of Zrn on the CeO2(111) surface
Johnatan Mucelini , Rafael Costa-Amaral , Yohanna Seminovski , Juarez L. F. Da Silva
Journal of Chemical Physics 149 ( 24) 244702 -244710
3
2018
The role of the anionic and cationic pt sites in the adsorption site preference of water and ethanol on defected Pt 4 /Pt(111) substrates: A density functional theory investigation within the D3 van der waals corrections
Yohanna Seminovski , Rafael C Amaral , Polina Tereshchuk , Juarez LF Da Silva
Surface Science 667 84 -91
4
2018
V-doped SnS2: a new intermediate band material for a better use of the solar spectrum
Perla Wahnón , José C. Conesa , Pablo Palacios , Raquel Lucena
Physical Chemistry Chemical Physics 13 ( 45) 20401 -20407
57
2011
Analysis of SnS2 hyperdoped with V proposed as efficient absorber material.
Yohanna Seminovski , Pablo Palacios , Perla Wahnón
Journal of Physics: Condensed Matter 26 ( 39) 395501
7
2014
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 Waals Correction
Rafael C Amaral , Polina Tereshchuk , Yohanna Seminovski , Juarez LF Da Silva
Journal of Physical Chemistry C 121 ( 6) 3445 -3454
7
2017
The role of charge transfer in the oxidation state change of Ce atoms in the TM13–CeO2(111) systems (TM = Pd, Ag, Pt, Au): a DFT + U investigation
Polina Tereshchuk , Rafael LH Freire , Crina G Ungureanu , Yohanna Seminovski
Physical Chemistry Chemical Physics 17 ( 20) 13520 -13530
41
2015
The role of the cationic Pt sites in the adsorption properties of water and ethanol on the Pt4/Pt(111) and Pt4/CeO2(111) substrates: A density functional theory investigation.
Yohanna Seminovski , Polina Tereshchuk , Adam Kiejna , Juarez L. F. Da Silva
Journal of Chemical Physics 145 ( 12) 124709 -124709
7
2016
Ab initio insights into the structural, energetic, electronic, and stability properties of mixed CenZr15-nO30 nanoclusters.
Priscilla Felício-Sousa , Johnatan Mucelini , Larissa Zibordi-Besse , Karla F. Andriani
Physical Chemistry Chemical Physics 21 ( 48) 26637 -26646
2
2019
Band gap control via tuning of inversion degree in CdIn2S4 spinel
Yohanna Seminovski , Pablo Palacios , Perla Wahnón , Ricardo Grau-Crespo
Applied Physics Letters 100 ( 10) 102112
33
2012
Supporting Information: The Role of the Cationic Pt Sites in the Adsorption Properties of Water and Ethanol on the Pt
Yohanna Seminovski , Polina Tereshchuk , Adam Kiejna , Juarez LF
System 3 ( 2a0) 2a0 -2a0
The Role of the Cationic Pt Sites in the Adsorption Properties of Water and Ethanol on the Pt
Yohanna Seminovski , Polina Tereshchuk , Adam Kiejna , Juarez LF
surfaces 2 111 -111
The Role of Charge Transfer in the Oxidation State Change of Ce Atoms in the TM
Polina Tereshchuk , Rafael LH Freire , Crina G Ungureanu , Yohanna Seminovski