Corrected several bugs in the interpolation of the
Test to sho Cesare how svn commit works
example, bin and makefile
First Version of Cesare QPI code
In the non collinear case the dos was the total dos
I introduced a small error when implementing born efective charge.
Obsolete
Oliviero version shifted in branches directory
New makefile for the frolich vertex
This should be the complete implementation of the frolich vertex.
The routines inside gvectors.F90 should calculate
I extracted from io_routines.F90 the routines
I extracted from io_routines.F90 the routines
After comparison with Quantum Espresso 6.3 the linewidth
After comparison with Quantum Espresso 6.3 the linewidth
The option calculation='gmat' was not working.
This routine generates the G vector from -ngx,y,z to +ngx,y,z
Beginning of implementation of the froelich vertex as in
Calculation of phonon frequencies, test without symmetrization.
This is a test for the phonon linewidth between epiq svn
This is a benchmark case for the calculation
For better readability I have extracted all the options
Makefile for new version of epiq with
Some comments explaining what we calculate in the routine
I corrected a small harmless bug. A bad definition
The calculation of the phonon linewidth is now
make.sys for polish-up version
Added bin directory for polishup version
Added src to polish-up version
Polished version of epiq shold stay in this directory.
Spurious dependence from broyden.f90 eliminated
Polish up, several writing eliminated from
Added the case imp.ne.0 namely when minus q
Example MgB2: Wannierisation step.
Upload of directory for MgB2 example.
Initial Version of EPIQ SVN.
Initial make.sys and instructions
Add initial directories
Add initial directories