SPCM in KKRASA (GREENS)


Level of support

Tier 2 NSC has only limited experience with this software, but we will try to help as much as possible. We have ran some tests, for example, if the program comes with a test suite, but they may be far from exhaustive. We will try to install and test new versions, as soon as we can.

Please see the page describing our software support categories for more information.
You can also contact support@nsc.liu.se for further information.

Installation of SPCM. It is used for building supercells and setting up the corresponding Madelung matrix. It can create special quasirandom structures (SQS). Used for instance by LSGF and ELSGF.

The KKRASA (GREENS) installations are generally maintained by Weine Olovsson (weiol@nsc.liu.se).

The different builds will be listed here below.

source_28Jun2008/spcm.exe from makefile.1:

PROG = spc
FC = ifort
LIBS = ../../lmtolib/lmtolib.1.a 
FFLAGS = -O2
#FFLAGS = -check all