problems in LDA-TM potential

Documentation, Web site and code modifications

Moderators: baguetl, routerov

Locked
ntuxi
Posts: 10
Joined: Thu Mar 25, 2010 10:26 am

problems in LDA-TM potential

Post by ntuxi » Fri Jan 02, 2015 9:32 am

Dear All

are the LDA-TM potentials (http://www.abinit.org/downloads/psp-lin ... nks/lda_tm) are scalar relativisitic or non-relativistic potential?

Thanks
Top
User avatar
jzwanzig
Posts: 504
Joined: Mon Aug 17, 2009 9:25 am

Re: problems in LDA-TM potential

Post by jzwanzig » Tue May 05, 2015 6:25 pm

most probably scalar relativistic as that is the default of the fhi98 generator.
Josef W. Zwanziger
Professor, Department of Chemistry
Canada Research Chair in NMR Studies of Materials
Dalhousie University
Halifax, NS B3H 4J3 Canada
jzwanzig@gmail.com
Top
Locked

Return to “Improving ABINIT”