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qbox

1.78.4_1

First-principles molecular dynamics code

Qbox is a C++/MPI scalable parallel implementation of first-principles molecular dynamics (FPMD) based on the plane-wave, pseudopotential formalism. Qbox is designed for operation on large parallel computers. Qbox is developed in the Gygi Research Group at UC Davis.

Origin: science/qbox
Category: science
Size: 1.48MiB
License: GPLv2+
Maintainer: yuri@FreeBSD.org
Dependencies: 9 packages
Required by: 0 packages
Website: qboxcode.org
$pkg install qbox

Dependencies (9)

xerces-c3scalapackmpichlibuuidlibiconvlapackfftw3curlblas

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