4 Commits

Author	SHA1	Message	Date
Paolo Giannozzi	6148f5e5c5	Obscure line present in all examples replaced with a much simpler one. ... See https://stackoverflow.com/questions/50148175/what-does-cd-echo-0-sed-s-1-do-in-bash-script Note: some trailing blanks have been removed as well by the script I used. Use "git diff -b" to see only the true changes.	2022-09-03 11:53:33 +02:00
Iurii Timrov	39a77cecc0	New input hubbard	2022-02-17 21:28:26 +00:00
Iurii Timrov	a0ae1121eb	Modifications in TDDFPT and HP modules: ... 1) Remove PP files from examples of TDDFPT, use an automatic download of PPs from the QE web site; 2) TDDFPT examples are now in the standard format of QE (using run_example scripts); 3) Fix the bug in TDDFPT+EXX due to recent changes in PW (fft_fact); 4) The ecutfock parameter in TDDFPT+EXX is now read from XML and cannot be specified from the input of TDDFPT; 5) In TDDFPT the oscillator strength (absorption coefficient) is now written in a separate file (and not in the same file where \chi is written); 6) HP examples use PPs from the Pslibrary by an automatic download from the QE website.	2018-09-07 16:26:46 +02:00
Iurii Timrov	0bc76d8100	Implementation of the new code hp.x to compute Hubbard U from DFPT. ... Iurii Timrov, Nicola Marzari, and Matteo Cococcioni, Phys. Rev. B 98, 085127 (2018); arXiv:1805.01805	2018-08-29 14:54:42 +02:00