RE: [SIESTA-L] erro Siesta 3-b

2010-03-08 Por tôpico Matheus Matos
appeared frequently. I have used a fdf file from the old version. There may be a correlation? Does anyone know how to solve? Thanks, Matheus Matos siesta: == Begin CG move = 0

[SIESTA-L] erro Siesta 3-b

2010-03-08 Por tôpico Matheus Matos
Hello everyone, I am doing some calculations with the new version of SIESTA, and the error message below has appeared frequently. I have used a fdf file from the old version. There may be a correlation? Does anyone know how to solve? Thanks, Matheus Matos siesta

RE: [SIESTA-L] siesta 3

2010-02-26 Por tôpico Matheus Matos
The same thing happens to me. However, I managed to compile with g95 and its libraries lapack and blas, run a job with larger mesh and a larger system. Matheus Matos > Date: Fri, 26 Feb 2010 10:26:38 -0500 > From: ovoz...@gmail.com > To: SIESTA-L@uam.es > Subject: [SIESTA-L] sies

[SIESTA-L] Fatal Error: Can't open module file 'siestaxc.mod'

2009-12-04 Por tôpico Matheus Matos
27; at (1) for reading: No such file or directory make: *** [forhar.o] Error 1 Does anyone know how to solve? I noticed that the *. mod related SiestaXC not been created. Any problems wi

[SIESTA-L] error: undefined reference to

2009-12-02 Por tôpico Matheus Matos
hen I compiled, the siesta-trunk-3.01 (make transiesta),using g95, I found the following error message. Someone knows how to solve? what should I do? Thanks, Matheus Matos /exp/home/backup/matheus/machado/matheus/siesta/siesta-trunk-301/Src/chkgmx.f:101: undefined reference to

[SIESTA-L] Re:error in a transiesta calculation

2009-11-23 Por tôpico Matheus Matos
. I'm not able to perform this with the new version. I would appreciate any help. Thanks Matheus Matos PhD. Student Electronic Structure Group UFMG-BRAZIL _ Converse e compartilhe fot