Activity for Matteo Calandra
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Matteo Calandra committed [r41]
Corrected several bugs in the interpolation of the
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Test to sho Cesare how svn commit works
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example, bin and makefile
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First Version of Cesare QPI code
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In the non collinear case the dos was the total dos
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I introduced a small error when implementing born efective charge.
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Obsolete
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Oliviero version shifted in branches directory
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New makefile for the frolich vertex
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This should be the complete implementation of the frolich vertex.
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The routines inside gvectors.F90 should calculate
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I extracted from io_routines.F90 the routines
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I extracted from io_routines.F90 the routines
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After comparison with Quantum Espresso 6.3 the linewidth
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After comparison with Quantum Espresso 6.3 the linewidth
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The option calculation='gmat' was not working.
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This routine generates the G vector from -ngx,y,z to +ngx,y,z
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Beginning of implementation of the froelich vertex as in
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Calculation of phonon frequencies, test without symmetrization.
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This is a test for the phonon linewidth between epiq svn
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This is a benchmark case for the calculation
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For better readability I have extracted all the options
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Makefile for new version of epiq with
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Some comments explaining what we calculate in the routine
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I corrected a small harmless bug. A bad definition
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The calculation of the phonon linewidth is now
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make.sys for polish-up version
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Added bin directory for polishup version
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Added src to polish-up version
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Polished version of epiq shold stay in this directory.
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Spurious dependence from broyden.f90 eliminated
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Polish up, several writing eliminated from
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Added the case imp.ne.0 namely when minus q
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Example MgB2: Wannierisation step.
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Upload of directory for MgB2 example.
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Initial Version of EPIQ SVN.
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Initial make.sys and instructions
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Add initial directories
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Add initial directories
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