qmpy

Suite of computational materials science tools

Project description

qmpy is a loose framework of tools for undertaking large computational materials projects, targeted specifically at database of density functional theory calculations but largely flexible to individual needs. The emphasis is on simplifying the day-to-day work of computational materials science, to let you get to the science.

Documentation

Read the docs: http://qmpy.readthedocs.org/

Project details

Release history Release notifications | RSS feed

1.4.0

Sep 30, 2020

1.3.0

Nov 6, 2019

1.2.0

Sep 28, 2018

1.1.0.post1

May 3, 2018

1.1.0

May 3, 2018

0.4.9a pre-release

Apr 15, 2014

0.4.8

Mar 24, 2014

0.4.7

Mar 17, 2014

0.3.3

Feb 26, 2014

0.3.1

Nov 14, 2013

0.3.0

Nov 8, 2013

0.2.1

Nov 8, 2013

0.2.0

Nov 8, 2013

0.1.2

Nov 4, 2013

0.1.1

Oct 29, 2013

0.1.0

Oct 21, 2013

0.0.1

Aug 6, 2013

0.0.0

Aug 6, 2013

This version

0.4.6e

Mar 3, 2014

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Source Distribution

qmpy-0.4.6e.tar.gz (285.8 kB view hashes)

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qmpy-0.4.6e-py2.7.egg (529.1 kB view hashes)

Uploaded Mar 3, 2014 Source

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