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The Journal of Chemical Physics
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October 8, 2022
DMC-ICE13: Ambient and high pressure polymorphs of ice from diffusion Monte Carlo and density functional theory
Flaviano Della Pia, Andrea Zen, Dario Alfè, et al.
Physical Review Letters
|
August 9, 2024
How Accurate Are Simulations and Experiments for the Lattice Energies of Molecular Crystals?
Flaviano Della Pia, Andrea Zen, Dario Alfè, et al.
Chemical Science
|
May 26, 2025
Accurate and efficient machine learning interatomic potentials for finite temperature modelling of molecular crystals
Flaviano Della Pia, Benjamin X Shi, Venkat Kapil, et al.
The Journal of Chemical Physics
|
December 10, 2024
On the increase of the melting temperature of water confined in one-dimensional nano-cavities
Flaviano Della Pia, Andrea Zen, Venkat Kapil, et al.
The Journal of Chemical Physics
|
August 19, 2025
Interaction strength of carbon dioxide on graphene from periodic quantum diffusion Monte Carlo
Flaviano Della Pia, Giaan Kler-Young, Andrea Zen, et al.
The Journal of Chemical Physics
|
April 9, 2025
Systematic discrepancies between reference methods for noncovalent interactions within the S66 dataset
Benjamin X Shi, Flaviano Della Pia, Yasmine S Al-Hamdani, et al.
Faraday Discussions
|
September 27, 2024
Data-efficient fine-tuning of foundational models for first-principles quality sublimation enthalpies
Harveen Kaur, Flaviano Della Pia, Ilyes Batatia, et al.
The Journal of Chemical Physics
|
September 8, 2025
Reproducibility of fixed-node diffusion Monte Carlo across diverse community codes: The case of water-methane dimer
Flaviano Della Pia, Benjamin X Shi, Yasmine S Al-Hamdani, et al.
Faraday Discussions
|
January 4, 2024
Dynamics and nano-rheology of interfacial water: general discussion
Xavier R Advincula, Katarina E Blow, Mischa Bonn, et al.
Faraday Discussions
|
January 4, 2024
Ice interfaces: general discussion
Xavier R Advincula, Ellen H G Backus, Thorsten Bartels-Rausch, et al.
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of 2
Search research articles
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Showing results (1-10 of 11) with videos related to
Sort By:
Page
of 2
The Journal of Chemical Physics
|
October 8, 2022
DMC-ICE13: Ambient and high pressure polymorphs of ice from diffusion Monte Carlo and density functional theory
Flaviano Della Pia, Andrea Zen, Dario Alfè, et al.
Physical Review Letters
|
August 9, 2024
How Accurate Are Simulations and Experiments for the Lattice Energies of Molecular Crystals?
Flaviano Della Pia, Andrea Zen, Dario Alfè, et al.
Chemical Science
|
May 26, 2025
Accurate and efficient machine learning interatomic potentials for finite temperature modelling of molecular crystals
Flaviano Della Pia, Benjamin X Shi, Venkat Kapil, et al.
The Journal of Chemical Physics
|
December 10, 2024
On the increase of the melting temperature of water confined in one-dimensional nano-cavities
Flaviano Della Pia, Andrea Zen, Venkat Kapil, et al.
The Journal of Chemical Physics
|
August 19, 2025
Interaction strength of carbon dioxide on graphene from periodic quantum diffusion Monte Carlo
Flaviano Della Pia, Giaan Kler-Young, Andrea Zen, et al.
The Journal of Chemical Physics
|
April 9, 2025
Systematic discrepancies between reference methods for noncovalent interactions within the S66 dataset
Benjamin X Shi, Flaviano Della Pia, Yasmine S Al-Hamdani, et al.
Faraday Discussions
|
September 27, 2024
Data-efficient fine-tuning of foundational models for first-principles quality sublimation enthalpies
Harveen Kaur, Flaviano Della Pia, Ilyes Batatia, et al.
The Journal of Chemical Physics
|
September 8, 2025
Reproducibility of fixed-node diffusion Monte Carlo across diverse community codes: The case of water-methane dimer
Flaviano Della Pia, Benjamin X Shi, Yasmine S Al-Hamdani, et al.
Faraday Discussions
|
January 4, 2024
Dynamics and nano-rheology of interfacial water: general discussion
Xavier R Advincula, Katarina E Blow, Mischa Bonn, et al.
Faraday Discussions
|
January 4, 2024
Ice interfaces: general discussion
Xavier R Advincula, Ellen H G Backus, Thorsten Bartels-Rausch, et al.
Page
of 2