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Journal of Chemical Information and Modeling
|
August 8, 2023
SANS Spectra with PLUMED: Implementation and Application to Metainference
Henrique M Cezar, Michele Cascella
Journal of Chemical Information and Modeling
|
May 30, 2020
DICE: A Monte Carlo Code for Molecular Simulation Including the Configurational Bias Monte Carlo Method
Henrique M Cezar, Sylvio Canuto, Kaline Coutinho
Journal of the American Chemical Society
|
January 10, 2024
Quantum Definition of Molecular Structure
Lucas Lang, Henrique M Cezar, Ludwik Adamowicz, et al.
The Journal of Chemical Physics
|
November 30, 2019
Thermodynamic properties of 55-atom Pt-based nanoalloys: Phase changes and structural effects on the electronic properties
Henrique M Cezar, Gustavo G Rondina, Juarez L F Da Silva
The Journal of Chemical Physics
|
February 17, 2017
Parallel tempering Monte Carlo combined with clustering Euclidean metric analysis to study the thermodynamic stability of Lennard-Jones nanoclusters
Henrique M Cezar, Gustavo G Rondina, Juarez L F Da Silva
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
January 19, 2021
A QM/MM study of the conformation stability and electronic structure of the photochromic switches derivatives of DHA/VHF in acetonitrile solution
Marcelo Hidalgo Cardenuto, Henrique M Cezar, Kurt V Mikkelsen, et al.
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
April 6, 2016
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
Douglas G De Souza, Henrique M Cezar, Gustavo G Rondina, et al.
Page
of 1
Search research articles
Search
Showing results (1-10 of 7) with videos related to
Sort By:
Page
of 1
Journal of Chemical Information and Modeling
|
August 8, 2023
SANS Spectra with PLUMED: Implementation and Application to Metainference
Henrique M Cezar, Michele Cascella
Journal of Chemical Information and Modeling
|
May 30, 2020
DICE: A Monte Carlo Code for Molecular Simulation Including the Configurational Bias Monte Carlo Method
Henrique M Cezar, Sylvio Canuto, Kaline Coutinho
Journal of the American Chemical Society
|
January 10, 2024
Quantum Definition of Molecular Structure
Lucas Lang, Henrique M Cezar, Ludwik Adamowicz, et al.
The Journal of Chemical Physics
|
November 30, 2019
Thermodynamic properties of 55-atom Pt-based nanoalloys: Phase changes and structural effects on the electronic properties
Henrique M Cezar, Gustavo G Rondina, Juarez L F Da Silva
The Journal of Chemical Physics
|
February 17, 2017
Parallel tempering Monte Carlo combined with clustering Euclidean metric analysis to study the thermodynamic stability of Lennard-Jones nanoclusters
Henrique M Cezar, Gustavo G Rondina, Juarez L F Da Silva
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
January 19, 2021
A QM/MM study of the conformation stability and electronic structure of the photochromic switches derivatives of DHA/VHF in acetonitrile solution
Marcelo Hidalgo Cardenuto, Henrique M Cezar, Kurt V Mikkelsen, et al.
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
April 6, 2016
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
Douglas G De Souza, Henrique M Cezar, Gustavo G Rondina, et al.
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of 1