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Commit Graph

10 Commits

Author SHA1 Message Date
Anthony Scemama
fdaaa4cfe0 One-electron density matrix OK + Bug corrected for phase factors 2011-03-23 13:46:05 +01:00
Anthony Scemama
21bebc57b4 Cleaned configure script 2010-10-08 12:36:02 +02:00
Anthony Scemama
4dc0e83a94 Bug in configure script 2010-07-16 14:59:17 +02:00
Anthony Scemama
35b8342b3e Added aim executable 2010-06-30 00:03:01 +02:00
Anthony Scemama
55b17c0384 Removed q5cost from to_ezfio.exe 2010-06-29 14:03:39 +02:00
Anthony Scemama
f463cb672e Configure script 2010-06-22 21:31:56 +02:00
Anthony Scemama
ba98fcf957 Improved input files. Work to do 2010-06-22 15:59:15 +02:00
Anthony Scemama
b0556c4f98 Introduced templates 2009-12-09 23:28:19 +01:00
Anthony Scemama
3a98a6f9de Added -DMPI to irpf90 2009-12-04 10:45:39 +01:00
Anthony Scemama
6d29b1d8c9 Improved Makefile and configure 2009-12-04 10:42:19 +01:00