Generalizing Neural Wave Functions

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Generalizing Neural Wave Functions

8 February 2023

Stephan Günnemann

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Papers citing "Generalizing Neural Wave Functions"

11 / 11 papers shown

Title
Learning Equivariant Non-Local Electron Density Functionals Nicholas Gao Eike Eberhard Stephan Günnemann 84 3 0 10 Oct 2024
Spherical Channels for Modeling Atomic Interactions C. L. Zitnick Abhishek Das Adeesh Kolluru Janice Lan Muhammed Shuaibi Anuroop Sriram Zachary W. Ulissi Brandon M. Wood 150 59 0 29 Jun 2022
Discovering Quantum Phase Transitions with Fermionic Neural Networks G. Cassella H. Sutterud Sam Azadi N. Drummond David Pfau J. Spencer W. Foulkes 65 46 0 10 Feb 2022
GemNet: Universal Directional Graph Neural Networks for Molecules Johannes Klicpera Florian Becker Stephan Günnemann AI4CE 129 464 0 02 Jun 2021
Solving the electronic Schrödinger equation for multiple nuclear geometries with weight-sharing deep neural networks Michael Scherbela Rafael Reisenhofer Leon Gerard P. Marquetand Philipp Grohs 76 51 0 18 May 2021
Deep neural network solution of the electronic Schrödinger equation J. Hermann Zeno Schätzle Frank Noé 245 457 0 16 Sep 2019
Ab-Initio Solution of the Many-Electron Schrödinger Equation with Deep Neural Networks David Pfau J. Spencer A. G. Matthews W. Foulkes 93 466 0 05 Sep 2019
Large Batch Optimization for Deep Learning: Training BERT in 76 minutes Yang You Jing Li Sashank J. Reddi Jonathan Hseu Sanjiv Kumar Srinadh Bhojanapalli Xiaodan Song J. Demmel Kurt Keutzer Cho-Jui Hsieh ODL 274 998 0 01 Apr 2019
Layer Normalization Jimmy Lei Ba J. Kiros Geoffrey E. Hinton 437 10,548 0 21 Jul 2016
Optimizing Neural Networks with Kronecker-factored Approximate Curvature James Martens Roger C. Grosse ODL 115 1,024 0 19 Mar 2015
Finding Density Functionals with Machine Learning John C. Snyder M. Rupp K. Hansen K. Müller K. Burke 132 477 0 22 Dec 2011