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Cecilia M S Alvares

Showing results (1-10 of 7) with videos related to

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Journal of Chemical Theory and Computation|March 17, 2025
Coarse-Grained Modeling of a Metal-Organic Framework/Polymer Composite and Its Gas Adsorption at the Nanoparticle LevelCecilia M S Alvares, Rocio Semino
The Journal of Chemical Physics|March 6, 2024
Force matching and iterative Boltzmann inversion coarse grained force fields for ZIF-8Cecilia M S Alvares, Rocio Semino
Journal of Physics. Condensed Matter : an Institute of Physics Journal|April 27, 2021
<i>Ab initio</i>based interionic interactions in calcium aluminotitanate oxide melts: structure and diffusionNoël Jakse, Cecilia M S Alvares, Alexander Pisch
Journal of Chemical Theory and Computation|June 8, 2026
Reactive Coarse Grained Force Field for Metal-Organic Frameworks Applied to Modeling ZIF-8 Self-AssemblySangita Mondal, Cecilia M S Alvares, Rocio Semino
The Journal of Chemical Physics|May 17, 2023
Coarse-grained modeling of zeolitic imidazolate framework-8 using MARTINI force fieldsCecilia M S Alvares, Guillaume Maurin, Rocio Semino
The Journal of Chemical Physics|March 2, 2020
Thermodynamics and structural properties of CaO: A molecular dynamics simulation studyCecilia M S Alvares, Guillaume Deffrennes, Alexander Pisch, et al.
Journal of Applied Crystallography|January 19, 2026
Optimal ratio or historical convention: the use of methanol-ethanol mixtures as pressure-transmitting mediumsCameron J G Wilson, Cecilia M S Alvares, Anna Herlihy, et al.
Pageof 1

Showing results (1-10 of 7) with videos related to

Sort By:
Pageof 1
Journal of Chemical Theory and Computation|March 17, 2025
Coarse-Grained Modeling of a Metal-Organic Framework/Polymer Composite and Its Gas Adsorption at the Nanoparticle LevelCecilia M S Alvares, Rocio Semino
The Journal of Chemical Physics|March 6, 2024
Force matching and iterative Boltzmann inversion coarse grained force fields for ZIF-8Cecilia M S Alvares, Rocio Semino
Journal of Physics. Condensed Matter : an Institute of Physics Journal|April 27, 2021
<i>Ab initio</i>based interionic interactions in calcium aluminotitanate oxide melts: structure and diffusionNoël Jakse, Cecilia M S Alvares, Alexander Pisch
Journal of Chemical Theory and Computation|June 8, 2026
Reactive Coarse Grained Force Field for Metal-Organic Frameworks Applied to Modeling ZIF-8 Self-AssemblySangita Mondal, Cecilia M S Alvares, Rocio Semino
The Journal of Chemical Physics|May 17, 2023
Coarse-grained modeling of zeolitic imidazolate framework-8 using MARTINI force fieldsCecilia M S Alvares, Guillaume Maurin, Rocio Semino
The Journal of Chemical Physics|March 2, 2020
Thermodynamics and structural properties of CaO: A molecular dynamics simulation studyCecilia M S Alvares, Guillaume Deffrennes, Alexander Pisch, et al.
Journal of Applied Crystallography|January 19, 2026
Optimal ratio or historical convention: the use of methanol-ethanol mixtures as pressure-transmitting mediumsCameron J G Wilson, Cecilia M S Alvares, Anna Herlihy, et al.
Pageof 1