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Ajay Panyala's Projects

blis icon blis

BLAS-like Library Instantiation Software Framework

ctf icon ctf

Cyclops Tensor Framework: parallel arithmetic on multidimensional arrays

exchcxx icon exchcxx

Exchange correlation (XC) library for density functional theory (DFT) calculations in modern C++

ga icon ga

Partitioned Global Address Space (PGAS) library for distributed arrays

gauxc icon gauxc

GauXC is a modern, modular C++ library for the evaluation of quantities related to the exchange-correlation (XC) energy (e.g. potential, etc) in the Gaussian basis set discretization of Kohn-Sham density function theory (KS-DFT) on heterogenous architectures.

hptt icon hptt

High-Performance Tensor Transpose library

libint icon libint

Libint: high-performance library for computing Gaussian integrals in quantum mechanics

nwchem icon nwchem

NWChem: Open Source High-Performance Computational Chemistry

tiledarray icon tiledarray

A massively-parallel, block-sparse tensor framework written in C++

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