[Q-e-developers] LOBSTER 2.2 & Quantum ESPRESSO
Richard Dronskowski
drons at hal9000.ac.rwth-aachen.de
Tue Oct 17 12:06:37 CEST 2017
Dear Quantum ESPRESSO developers,
this is just to inform you that LOBSTER (a local-orbital basis suite
towards electronic-structure reconstruction) capable of projecting out
chemical-bonding information (and other stuff) from plane-wave packages
has just been upgraded to also digest Quantum ESPRESSO data. We have been
asked for such a port (besides the ports for VASP and ABINIT) for a long
time, and now it has been accomplished. Feel free to download LOBSTER 2.2
at www.cohp.de for free in case you are interested.
Best wishes from Aachen, Germany, on behalf of the LOBSTER team,
RD
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Professor Dr. Richard Dronskowski
Chair of Solid-State and Quantum Chemistry, RWTH Aachen, D-52056 Aachen
eMail: drons at HAL9000.ac.rwth-aachen.de Web: http://www.ssc.rwth-aachen.de
Tel: +49 (0) 241 80-93642 Fax: +49 (0) 241 80-92642
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