[Wien] runafm_lapw ver 19.1
Takuma Ogasawara
takuma.ogasawara.s4 at dc.tohoku.ac.jp
Wed Oct 9 13:02:37 CEST 2019
Dear Wien2k users,
I got a strange error massage
"vresp: Undefined variable."
during runafm_lapw btw lapw1 and lapw2 without any other option
(where I just use spin ).
As I know, case.vresp is used for advansed option such as mJB.
And I can do non magnetic scf calculation using run_lapw with same
crystal structure.
Thus I guess there are something wrong in runafm_lapw.
I find "set versp" on line 438 and 440 in runafm_lapw.
It suggest some other command loaded before this definition line.
Actually, when I move these lines to 195 that is just below the lines
that define other variables,
I confirm runafm_lapw works without error.
Anyway, I think runafm_lapw contains something wrong.
But I cannot clarify what is wrong due to my poor knowledge.
Could anyone check about it?
Thanks in advance.
with regards,
Takuma Ogasawara
------------------
Dept. Phys., Faculty of Sci., Tohoku Univ.
Nano Solid State Physics Lab.
Zipcode:980-8577 2-1-1, Katahira, Aoba-ku, Sendai-shi, Miyagi-prefecture
Tohoku University, WPI-AIMR main building, Floor 3, Room 3B
Zipcode980-8578 6-3, Aza-Aoba, Aramaki, Aoba-ku, Sendai-shi,
Miyagi-prefecture
Tohoku University, Department of Physics, Building A, Room 319
mail: takuma.ogasawara.s4 at dc.tohoku.ac.jp
TEL: +81 090-1542-3269
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