Albert Hofstetter

4PUBLICATIONS
17CO-AUTHORS
Theoretical quantum chemistryTheory and design of materialsElemental semiconductors
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Publications (4)

|Sep 15, 2022
Graph-convolutional neural networks for (QM)ML/MM molecular dynamics simulations.

Albert Hofstetter, Lennard Böselt, Sereina Riniker

|May 21, 2021
Structure determination of an amorphous drug through large-scale NMR predictions.

Manuel Cordova, Martins Balodis, Albert Hofstetter

|Oct 17, 2019
Ba-induced phase segregation and band gap reduction in mixed-halide inorganic perovskite solar cells.

Wanchun Xiang, Zaiwei Wang, Dominik J Kubicki

|Oct 31, 2018
Chemical shifts in molecular solids by machine learning.

Federico M Paruzzo, Albert Hofstetter, Félix Musil

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