[Wien] L2main - QTL-B Error with spin-orbit caluclation

2012-02-18 Thread Ghosh SUDDHASATTWA
list for WIEN2k users Subject: [Wien] L2main - QTL-B Error with spin-orbit caluclation Dears developers and users, I did my calculation for my case peroveskite with the RMT of the wien2k i used the same steps like in the user guide : ( run[sp]_lapw , save_lapw case_nrel , initso_lapw

[Wien] L2main - QTL-B Error with spin-orbit caluclation

2012-02-18 Thread sufyan
**] L2main - QTL-B Error with spin-orbit caluclation ** ** Dears developers and users, I did my calculation for my case peroveskite with the RMT of the wien2k i used the same steps like in the user guide : ( run[sp]_lapw , save_lapw case_nrel , initso_lapw and then run[sp]_lapw

[Wien] L2main - QTL-B Error with spin-orbit caluclation

2012-02-18 Thread sufyan
] *On Behalf Of *sufyan *Sent:* Friday, February 17, 2012 11:14 PM *To:* A** **Mailing list** **for** **WIEN2k** **users *Subject:* [**Wien**] L2main - QTL-B Error with spin-orbit caluclation*** * ** ** Dears developers and users, I did my calculation for my case peroveskite

[Wien] L2main - QTL-B Error with spin-orbit caluclation

2012-02-18 Thread Laurence Marks
users Subject: [Wien] L2main - QTL-B Error with spin-orbit caluclation Dears developers and users, I did my calculation for my case peroveskite with the RMT of the wien2k i used the same steps like in the user guide : ?? ( run[sp]_lapw? , save_lapw case_nrel , initso_lapw and then run

[Wien] L2main - QTL-B Error with spin-orbit caluclation

2012-02-17 Thread sufyan
Dears developers and users, I did my calculation for my case peroveskite with the RMT of the wien2k i used the same steps like in the user guide : ( run[sp]_lapw , save_lapw case_nrel , initso_lapw and then run[sp]_lapw -so ) and it work very well. when i want calculate for another RMT of

[Wien] L2main - QTL-B Error with spin-orbit caluclation

2012-02-17 Thread Laurence Marks
17, 2012 11:14 PM *To:* A** **Mailing list** **for** **WIEN2k** **users *Subject:* [**Wien**] L2main - QTL-B Error with spin-orbit caluclation ** ** Dears developers and users, I did my calculation for my case peroveskite with the RMT of the wien2k i used the same steps like