47 citations · 108 across the 6 of their papers we have counts for
Showing 2020Show all
2 papers · 1 filter
physics.chem-ph2020★ 1 cited
Coulomb Interactions between Dipolar Quantum Fluctuations in van der Waals Bound Molecules and Materials
Martin Stöhr, Mainak Sadhukhan, Yasmine S. Al-Hamdani +2
Mutual Coulomb interactions between electrons lead to a plethora of interesting physical and chemical effects, especially if those interactions involve many fluctuating electrons o…
physics.chem-ph2020
Accurate Many-Body Repulsive Potentials for Density-Functional Tight-Binding from Deep Tensor Neural Networks
Martin Stöhr, Leonardo Medrano Sandonas, Alexandre Tkatchenko
We combine density-functional tight-binding (DFTB) with deep tensor neural networks (DTNN) to maximize the strengths of both approaches in predicting structural, energetic, and vib…