Search Results for author: Venkat Viswanathan

Found 3 papers, 1 papers with code

Open-Source Fermionic Neural Networks with Ionic Charge Initialization

no code implementations16 Jan 2024 Shai Pranesh, Shang Zhu, Venkat Viswanathan, Bharath Ramsundar

Finding accurate solutions to the electronic Schr\"odinger equation plays an important role in discovering important molecular and material energies and characteristics.

Variational Monte Carlo

Open Source Infrastructure for Differentiable Density Functional Theory

no code implementations27 Sep 2023 Advika Vidhyadhiraja, Arun Pa Thiagarajan, Shang Zhu, Venkat Viswanathan, Bharath Ramsundar

Learning exchange correlation functionals, used in quantum chemistry calculations, from data has become increasingly important in recent years, but training such a functional requires sophisticated software infrastructure.

Rotation Equivariant Operators for Machine Learning on Scalar and Vector Fields

1 code implementation21 Aug 2021 Paul Shen, Michael Herbst, Venkat Viswanathan

We develop theory and software for rotation equivariant operators on scalar and vector fields, with diverse applications in simulation, optimization and machine learning.

BIG-bench Machine Learning Translation

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