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The Journal of Physical Chemistry Letters
|
January 8, 2019
Physisorption of Water on Graphene: Subchemical Accuracy from Many-Body Electronic Structure Methods
Jan Gerit Brandenburg, Andrea Zen, Martin Fitzner, et al.
Langmuir : the ACS Journal of Surfaces and Colloids
|
January 5, 2019
Adsorption Behavior of Organic Molecules: A Study of Benzotriazole on Cu(111) with Spectroscopic and Theoretical Methods
Chiara Gattinoni, Panayiotis Tsaousis, Chanan Euaruksakul, et al.
Journal of Chemical Theory and Computation
|
November 7, 2025
Towards Routine Condensed Phase Simulations with Delta-Learned Coupled Cluster Accuracy: Application to Liquid Water
Niamh O'Neill, Benjamin X Shi, William J Baldwin, et al.
The Journal of Physical Chemistry Letters
|
July 6, 2022
Observation and Characterization of Dicarbonyls on a RhCu Single-Atom Alloy
Yicheng Wang, Julia Schumann, Elizabeth E Happel, et al.
Nature Communications
|
June 29, 2013
Quantum simulation of low-temperature metallic liquid hydrogen
Ji Chen, Xin-Zheng Li, Qianfan Zhang, 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.
Journal of Chemical Theory and Computation
|
November 2, 2023
Mesoscale Simulations Reveal How Salt Influences Clay Particles Agglomeration in Aqueous Dispersions
Tran Thi Bao Le, Aaron R Finney, Andrea Zen, et al.
Chemical Science
|
June 3, 2022
The role of structural order in heterogeneous ice nucleation
Gabriele C Sosso, Prerna Sudera, Anna T Backes, et al.
Physical Review Letters
|
April 16, 2021
Microscopic Kinetics Pathway of Salt Crystallization in Graphene Nanocapillaries
Lifen Wang, Ji Chen, Stephen J Cox, et al.
The Journal of Chemical Physics
|
June 3, 2017
A comparison between quantum chemistry and quantum Monte Carlo techniques for the adsorption of water on the (001) LiH surface
Theodoros Tsatsoulis, Felix Hummel, Denis Usvyat, et al.
Page
of 20
Search research articles
Search
Showing results (161-170 of 197) with videos related to
Sort By:
Page
of 20
The Journal of Physical Chemistry Letters
|
January 8, 2019
Physisorption of Water on Graphene: Subchemical Accuracy from Many-Body Electronic Structure Methods
Jan Gerit Brandenburg, Andrea Zen, Martin Fitzner, et al.
Langmuir : the ACS Journal of Surfaces and Colloids
|
January 5, 2019
Adsorption Behavior of Organic Molecules: A Study of Benzotriazole on Cu(111) with Spectroscopic and Theoretical Methods
Chiara Gattinoni, Panayiotis Tsaousis, Chanan Euaruksakul, et al.
Journal of Chemical Theory and Computation
|
November 7, 2025
Towards Routine Condensed Phase Simulations with Delta-Learned Coupled Cluster Accuracy: Application to Liquid Water
Niamh O'Neill, Benjamin X Shi, William J Baldwin, et al.
The Journal of Physical Chemistry Letters
|
July 6, 2022
Observation and Characterization of Dicarbonyls on a RhCu Single-Atom Alloy
Yicheng Wang, Julia Schumann, Elizabeth E Happel, et al.
Nature Communications
|
June 29, 2013
Quantum simulation of low-temperature metallic liquid hydrogen
Ji Chen, Xin-Zheng Li, Qianfan Zhang, 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.
Journal of Chemical Theory and Computation
|
November 2, 2023
Mesoscale Simulations Reveal How Salt Influences Clay Particles Agglomeration in Aqueous Dispersions
Tran Thi Bao Le, Aaron R Finney, Andrea Zen, et al.
Chemical Science
|
June 3, 2022
The role of structural order in heterogeneous ice nucleation
Gabriele C Sosso, Prerna Sudera, Anna T Backes, et al.
Physical Review Letters
|
April 16, 2021
Microscopic Kinetics Pathway of Salt Crystallization in Graphene Nanocapillaries
Lifen Wang, Ji Chen, Stephen J Cox, et al.
The Journal of Chemical Physics
|
June 3, 2017
A comparison between quantum chemistry and quantum Monte Carlo techniques for the adsorption of water on the (001) LiH surface
Theodoros Tsatsoulis, Felix Hummel, Denis Usvyat, et al.
Page
of 20