Entos / packages

Package Name Access Summary Updated
libecpint public Libecpint is a C++ library for the efficient evaluation of integrals over ab initio effective core potentials, using a mixture of generated, recursive code and Gauss-Chebyshev quadrature 2020-12-14
libcint public General GTO integrals for quantum chemistry 2020-12-11
py-qcore public A Python wrapper for the Entos Qcore quantum chemistry package. 2020-11-14
qcore public Entos Qcore is a powerful suite of electronic structure and dynamics tools, built on cutting-edge quantum embedding 2020-11-14
codex public Schema and utilities for the Entos python ecosystem. 2020-11-12
entos public A Python wrapper for the Entos Qcore quantum chemistry package. 2020-10-20
qcore-boost-1.72.0 public Entos Qcore is a powerful suite of electronic structure and dynamics tools, built on cutting-edge quantum embedding 2020-07-22
libxc public M.A.L. Marques's exchange-correlation functionals for density-functional theory 2020-05-22

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