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SternheimerGW v0.14

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@martin-schlipf martin-schlipf released this 27 Oct 08:26
· 112 commits to master since this release
v0.14_qe6.2
96e36c6

Citation DOI

Martin Schlipf, Henry Lambert, Nourdine Zibouche, & Feliciano Giustino. (2017, October 27). SternheimerGW v0.14. Zenodo. http://doi.org/10.5281/zenodo.1037798

Installation

This release of SternheimerGW goes along with the recent release of Quantum ESPRESSO 6.2 (QE), so you need to download and configure QE first.
In this version, we fully utilize the new XML schema, so that a default configuration of QE can be used.

./configure
make pw lrmods

Then you can either clone this repository into the QE directory and manually build the code. As alternative, we provide the automatic build via the Makefile of QE

make SternheimerGW

which will download this release and install it.

New in this version

  • Input file redefined to make it more user friendly and fully documented on the website.
  • Tutorials for silicon, lithium, BN film, and LiCl added.
  • W can be plotted on the real axis after the analytic continuation.
  • AAA analytic continuation added for W.
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