Closed wasimrajamondal closed 10 years ago
dmftproj executable is included in triqs and installed in TRIQS_install_directory/bin . Hence, you should run it on the computer where you have triqs. If you do not have Wien-2k on it you can just create Wien2k/SRC_templates directory on its hard drive and copy into it the content of SRC_templates from another computer . You also define env. variable WIENROOT='path to this Wien-2k directory' Then dmftproj should be running (but you will not be able to run fully self-consistent LDA+DMFT on it, because for that you need the whole Wien-2k package).
I have installed wien2k in my desktop in ubuntu 11.04. I have run the wien2k and created the file case.almblm, case.dmftsym and case.structure file. I have installed triqs in another machine but not in this machine. In triqs i have got the dmftproj in the following path: /home/user_name/TRIQS/TRIQS-master/pytriqs/Wien2k/dmftproj/SRC_templates. From here I have copied case.cf_f_mm2, case.cf_p_cubic, case.indmftpr, run_triqs to another machine where I have installed wien2k. All these file I have kept in this path: /home/username/wien/SRC_templates. Now how should I run dmftproj? According to the user guide I should give command dmftproj. But it is telling command not found becasue triqs is not installed in this machine. So in the case of wien2k and triqs installed in two different machine how should I run dmftproj? please help me.