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Journal of Chemical Theory and Computation
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July 2, 2025
Accelerating Data Set Population for Training Machine Learning Potentials with Automated System Generation and Strategic Sampling
Alberto Pacini, Mauro Ferrario, Maria Clelia Righi
ACS Applied Nano Materials
|
July 24, 2025
Ab Initio Insights into Zinc Dialkyldithiophosphate Linkage Isomers and Oxidative Degradation: Implications for Tribology
Francesca Benini, Paolo Restuccia, Enrico Pedretti, et al.
Proceedings of the National Academy of Sciences of the United States of America
|
January 19, 2010
Onset of frictional slip by domain nucleation in adsorbed monolayers
Marco Reguzzoni, Mauro Ferrario, Stefano Zapperi, et al.
The Journal of Chemical Physics
|
August 25, 2025
Sliding properties of transition metal dichalcogenide bilayers
Pier Luigi Silvestrelli, S Subashchandrabose, Alberto Ambrosetti, et al.
ACS Applied Nano Materials
|
September 28, 2023
Nanotribological Properties of Oxidized Diamond/Silica Interfaces: Insights into the Atomistic Mechanisms of Wear and Friction by Ab Initio Molecular Dynamics Simulations
Huong Thi Thuy Ta, Nam Van Tran, Maria Clelia Righi
ACS Applied Nano Materials
|
September 5, 2022
Nanoscale MXene Interlayer and Substrate Adhesion for Lubrication: A Density Functional Theory Study
Edoardo Marquis, Michele Cutini, Babak Anasori, et al.
Nano Convergence
|
April 3, 2023
Effect of vacancies and edges in promoting water chemisorption on titanium-based MXenes
Edoardo Marquis, Francesca Benini, Babak Anasori, et al.
Journal of Chemical Theory and Computation
|
July 11, 2023
Accurate Multiscale Simulation of Frictional Interfaces by Quantum Mechanics/Green's Function Molecular Dynamics
Seiji Kajita, Alberto Pacini, Gabriele Losi, et al.
Molecules (Basel, Switzerland)
|
April 28, 2023
Interaction of Water and Oxygen Molecules with Phosphorene: An Ab Initio Study
Francesca Benini, Nicolò Bassoli, Paolo Restuccia, et al.
Physical Chemistry Chemical Physics : PCCP
|
October 12, 2016
Size-dependent commensurability and its possible role in determining the frictional behavior of adsorbed systems
Paolo Restuccia, Mauro Ferrario, Pier Luigi Sivestrelli, et al.
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Search research articles
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Showing results (1-10 of 21) with videos related to
Sort By:
Page
of 3
Journal of Chemical Theory and Computation
|
July 2, 2025
Accelerating Data Set Population for Training Machine Learning Potentials with Automated System Generation and Strategic Sampling
Alberto Pacini, Mauro Ferrario, Maria Clelia Righi
ACS Applied Nano Materials
|
July 24, 2025
Ab Initio Insights into Zinc Dialkyldithiophosphate Linkage Isomers and Oxidative Degradation: Implications for Tribology
Francesca Benini, Paolo Restuccia, Enrico Pedretti, et al.
Proceedings of the National Academy of Sciences of the United States of America
|
January 19, 2010
Onset of frictional slip by domain nucleation in adsorbed monolayers
Marco Reguzzoni, Mauro Ferrario, Stefano Zapperi, et al.
The Journal of Chemical Physics
|
August 25, 2025
Sliding properties of transition metal dichalcogenide bilayers
Pier Luigi Silvestrelli, S Subashchandrabose, Alberto Ambrosetti, et al.
ACS Applied Nano Materials
|
September 28, 2023
Nanotribological Properties of Oxidized Diamond/Silica Interfaces: Insights into the Atomistic Mechanisms of Wear and Friction by Ab Initio Molecular Dynamics Simulations
Huong Thi Thuy Ta, Nam Van Tran, Maria Clelia Righi
ACS Applied Nano Materials
|
September 5, 2022
Nanoscale MXene Interlayer and Substrate Adhesion for Lubrication: A Density Functional Theory Study
Edoardo Marquis, Michele Cutini, Babak Anasori, et al.
Nano Convergence
|
April 3, 2023
Effect of vacancies and edges in promoting water chemisorption on titanium-based MXenes
Edoardo Marquis, Francesca Benini, Babak Anasori, et al.
Journal of Chemical Theory and Computation
|
July 11, 2023
Accurate Multiscale Simulation of Frictional Interfaces by Quantum Mechanics/Green's Function Molecular Dynamics
Seiji Kajita, Alberto Pacini, Gabriele Losi, et al.
Molecules (Basel, Switzerland)
|
April 28, 2023
Interaction of Water and Oxygen Molecules with Phosphorene: An Ab Initio Study
Francesca Benini, Nicolò Bassoli, Paolo Restuccia, et al.
Physical Chemistry Chemical Physics : PCCP
|
October 12, 2016
Size-dependent commensurability and its possible role in determining the frictional behavior of adsorbed systems
Paolo Restuccia, Mauro Ferrario, Pier Luigi Sivestrelli, et al.
Page
of 3