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Shayantan Chaudhuri

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

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ACS Electrochemistry|July 10, 2025
Challenges in the Theory and Atomistic Simulation of Metal ElectrodepositionShayantan Chaudhuri, Reinhard J Maurer
The Journal of Physical Chemistry. C, Nanomaterials and Interfaces|August 23, 2023
Stability of Single Gold Atoms on Defective and Doped Diamond SurfacesShayantan Chaudhuri, Andrew J Logsdail, Reinhard J Maurer
Digital Discovery|September 12, 2022
Long-range dispersion-inclusive machine learning potentials for structure search and optimization of hybrid organic-inorganic interfacesJulia Westermayr, Shayantan Chaudhuri, Andreas Jeindl, et al.
Journal of Chemical Information and Modeling|September 12, 2024
Quantum Chemical Characterization of Rotamerism in Thio-Michael Additions for Targeted Covalent InhibitorsShayantan Chaudhuri, David M Rogers, Christopher J Hayes, et al.
The Journal of Chemical Physics|November 7, 2023
libMBD: A general-purpose package for scalable quantum many-body dispersion calculationsJan Hermann, Martin Stöhr, Szabolcs Góger, et al.
The Journal of Physical Chemistry Letters|August 12, 2025
Challenges and Advances in the Simulation of Targeted Covalent Inhibitors Using Quantum ComputingShayantan Chaudhuri, Bang C Huynh, Ross Amory, et al.
Nature Communications|December 8, 2021
Adiabatic versus non-adiabatic electron transfer at 2D electrode materialsDan-Qing Liu, Minkyung Kang, David Perry, et al.
Pageof 1

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

Sort By:
Pageof 1
ACS Electrochemistry|July 10, 2025
Challenges in the Theory and Atomistic Simulation of Metal ElectrodepositionShayantan Chaudhuri, Reinhard J Maurer
The Journal of Physical Chemistry. C, Nanomaterials and Interfaces|August 23, 2023
Stability of Single Gold Atoms on Defective and Doped Diamond SurfacesShayantan Chaudhuri, Andrew J Logsdail, Reinhard J Maurer
Digital Discovery|September 12, 2022
Long-range dispersion-inclusive machine learning potentials for structure search and optimization of hybrid organic-inorganic interfacesJulia Westermayr, Shayantan Chaudhuri, Andreas Jeindl, et al.
Journal of Chemical Information and Modeling|September 12, 2024
Quantum Chemical Characterization of Rotamerism in Thio-Michael Additions for Targeted Covalent InhibitorsShayantan Chaudhuri, David M Rogers, Christopher J Hayes, et al.
The Journal of Chemical Physics|November 7, 2023
libMBD: A general-purpose package for scalable quantum many-body dispersion calculationsJan Hermann, Martin Stöhr, Szabolcs Góger, et al.
The Journal of Physical Chemistry Letters|August 12, 2025
Challenges and Advances in the Simulation of Targeted Covalent Inhibitors Using Quantum ComputingShayantan Chaudhuri, Bang C Huynh, Ross Amory, et al.
Nature Communications|December 8, 2021
Adiabatic versus non-adiabatic electron transfer at 2D electrode materialsDan-Qing Liu, Minkyung Kang, David Perry, et al.
Pageof 1