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Commit Date  
[r507] by paulatz

A few fixes to properly apply LO-TO splitting when doing thermal transport calculation (and more in general, to correctly appl LO-TO sploitting on the grid used to integrate the self energy)

Courtesy of Michele Simoncelli.

2020-05-04 13:49:26 Tree
[r506] by paulatz

Fixed compilation when using recent git QE version, with upflib
Restructured calculation of frequency-dependt properties (selfenergy, spectral weight, dielectric constant) and tentative implementation of IR reflectivity (there is still a 2pi missing, or something and only cubic systems for the moment)

2020-04-30 10:00:00 Tree
[r505] by paulatz

Fixed compilation with new QE including upflib, and a bug when compiling without MPI spport

2020-04-30 09:58:00 Tree
[r504] by paulatz

optitmized grids fixed (although still a stupid idea, better way to optimize is in progress)

2020-04-03 14:45:30 Tree
[r503] by paulatz

removed debug line

2020-02-17 15:29:01 Tree
[r502] by paulatz

fix compatibility with new QE

2020-02-17 15:28:19 Tree
[r501] by paulatz

format

2020-02-17 15:27:51 Tree
[r500] by paulatz

fix

2020-02-17 15:27:36 Tree
[r499] by paulatz
2020-02-17 15:27:07 Tree
[r498] by paulatz

MgO example

2020-02-17 15:25:58 Tree
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