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Gustavo G. Rondina
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Revised Basin-Hopping Monte Carlo Algorithm for Structure Optimization of Clusters and Nanoparticles
GG Rondina, JLF Da Silva
J. Chem. Inf. Model. 53 (9), 2282-2298, 2013
1262013
The Role of Charge States in the Atomic Structure of Cun and Ptn (n= 2-14 atoms) Clusters: A DFT Investigation
AS Chaves, GG Rondina, MJ Piotrowski, P Tereshchuk, JLF Da Silva
J. Phys. Chem. A 118 (45), 10813-10821, 2014
1172014
Structural formation of binary PtCu clusters: A density functional theory investigation
AS Chaves, GG Rondina, MJ Piotrowski, JLF Da Silva
Computational Materials Science 98, 278-286, 2015
502015
Predicting the mobility increase of coarse-grained polymer models from excess entropy differences
GG Rondina, MC Böhm, F Müller-Plathe
Journal of Chemical Theory and Computation 16 (3), 1431-1447, 2020
332020
A basin-hopping Monte Carlo investigation of the structural and energetic properties of 55-and 561-atom bimetallic nanoclusters: the examples of the ZrCu, ZrAl, and CuAl systems
DG De Souza, HM Cezar, GG Rondina, MF de Oliveira, JLF Da Silva
Journal of Physics: Condensed Matter 28 (17), 175302, 2016
162016
Pushing the mass limit for intact launch and photoionization of large neutral biopolymers
J Schätti, P Rieser, U Sezer, G Richter, P Geyer, GG Rondina, ...
Communications Chemistry 1 (1), 93, 2018
152018
Parallel tempering Monte Carlo combined with clustering Euclidean metric analysis to study the thermodynamic stability of Lennard-Jones nanoclusters
HM Cezar, GG Rondina, JLF Da Silva
The Journal of Chemical Physics 146 (6), 064114, 2017
152017
Thermodynamic properties of 55-atom Pt-based nanoalloys: Phase changes and structural effects on the electronic properties
HM Cezar, GG Rondina, JLF Da Silva
The Journal of Chemical Physics 151 (20), 204301, 2019
102019
Novas ideias para o Método de Basin-Hopping Monte Carlo aplicado à otimização global de Clusters e Nanopartículas
GG Rondina
Institute of Physics of Sao Carlos, University of Sao Paulo, 2013
12013
Gotnano: a package to perform global optimization and thermodynamic properties of nanoparticles
JLF Silva, HM Cezar, GG Rondina
Program Book, 2014
2014
Revised Basin Hopping Monte Carlo Algorithm Applied for Nanoparticles
JLF Da Silva, GG Rondina
APS March Meeting 2013 58 (1), 2013
2013
Instrumentador de código para a linguagem Delphi
GG Rondina
Centro Universitário Eurípides de Marília, 2005
2005
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Articles 1–12