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Roohollah Hafizi

Showing results (1-10 of 11) with videos related to

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Physical Review Letters|December 9, 2017
Band Structure and Contact Resistance of Carbon Nanotubes Deformed by a Metal ContactRoohollah Hafizi, Jerry Tersoff, Vasili Perebeinos
Journal of Chemical Theory and Computation|June 22, 2023
Ultrafast Electronic Coupling Estimators: Neural Networks versus Physics-Based ApproachesRoohollah Hafizi, Jan Elsner, Jochen Blumberger
Nanomaterials (Basel, Switzerland)|June 10, 2023
Metal Contact Induced Unconventional Field Effect in Metallic Carbon NanotubesGeorgy Fedorov, Roohollah Hafizi, Vyacheslav Semenenko, et al.
The Journal of Physical Chemistry. A|January 26, 2024
Machine-Learned Potentials by Active Learning from Organic Crystal Structure Prediction LandscapesPatrick W V Butler, Roohollah Hafizi, Graeme M Day
The Journal of Physical Chemistry. A|September 4, 2020
Multifidelity Statistical Machine Learning for Molecular Crystal Structure PredictionOlga Egorova, Roohollah Hafizi, David C Woods, et al.
The Journal of Chemical Physics|December 24, 2017
A neural-network potential through charge equilibration for WS<sub>2</sub>: From clusters to sheetsRoohollah Hafizi, S Alireza Ghasemi, S Javad Hashemifar, et al.
The Journal of Chemical Physics|August 12, 2017
Stable isomers and electronic, vibrational, and optical properties of WS<sub>2</sub> nano-clusters: A first-principles studyRoohollah Hafizi, S Javad Hashemifar, Mojtaba Alaei, et al.
Journal of the American Chemical Society|October 16, 2025
Polar Triptycene-Based Nonmetal Organic Frameworks Show Enhanced Hydrogen AdsorptionMegan O'Shaughnessy, Hang Qu, Xue Wang, et al.
Nature|May 22, 2024
Porous isoreticular non-metal organic frameworksMegan O'Shaughnessy, Joseph Glover, Roohollah Hafizi, et al.
Faraday Discussions|December 12, 2024
Discovering chemical structure: general discussionAlán Aspuru-Guzik, Tim Bechtel, Varinia Bernales, et al.
Pageof 2

Showing results (1-10 of 11) with videos related to

Sort By:
Pageof 2
Physical Review Letters|December 9, 2017
Band Structure and Contact Resistance of Carbon Nanotubes Deformed by a Metal ContactRoohollah Hafizi, Jerry Tersoff, Vasili Perebeinos
Journal of Chemical Theory and Computation|June 22, 2023
Ultrafast Electronic Coupling Estimators: Neural Networks versus Physics-Based ApproachesRoohollah Hafizi, Jan Elsner, Jochen Blumberger
Nanomaterials (Basel, Switzerland)|June 10, 2023
Metal Contact Induced Unconventional Field Effect in Metallic Carbon NanotubesGeorgy Fedorov, Roohollah Hafizi, Vyacheslav Semenenko, et al.
The Journal of Physical Chemistry. A|January 26, 2024
Machine-Learned Potentials by Active Learning from Organic Crystal Structure Prediction LandscapesPatrick W V Butler, Roohollah Hafizi, Graeme M Day
The Journal of Physical Chemistry. A|September 4, 2020
Multifidelity Statistical Machine Learning for Molecular Crystal Structure PredictionOlga Egorova, Roohollah Hafizi, David C Woods, et al.
The Journal of Chemical Physics|December 24, 2017
A neural-network potential through charge equilibration for WS<sub>2</sub>: From clusters to sheetsRoohollah Hafizi, S Alireza Ghasemi, S Javad Hashemifar, et al.
The Journal of Chemical Physics|August 12, 2017
Stable isomers and electronic, vibrational, and optical properties of WS<sub>2</sub> nano-clusters: A first-principles studyRoohollah Hafizi, S Javad Hashemifar, Mojtaba Alaei, et al.
Journal of the American Chemical Society|October 16, 2025
Polar Triptycene-Based Nonmetal Organic Frameworks Show Enhanced Hydrogen AdsorptionMegan O'Shaughnessy, Hang Qu, Xue Wang, et al.
Nature|May 22, 2024
Porous isoreticular non-metal organic frameworksMegan O'Shaughnessy, Joseph Glover, Roohollah Hafizi, et al.
Faraday Discussions|December 12, 2024
Discovering chemical structure: general discussionAlán Aspuru-Guzik, Tim Bechtel, Varinia Bernales, et al.
Pageof 2