[Wien] GLLB-SC potential

[shaymlal dayananda]

Dear Dr. Tran and Dr. G.Abo
Thank you for your reply. 
I noticed in :log that it has already completed with  "Sat Dec  8 19:20:32 EST 2018> (x) lapw2 -all .5671450153 .5672550153"

Thank you

Shyam 

    On Sunday, December 9, 2018 9:45 AM, Gavin Abo <gsabo at crimson.ua.edu> wrote:
 

  FYI, that error is probably because X and Y have not been replaced by numbers like: x lapw2 -all 0.691 0.692 For the X and Y values used in your case, you might try checking the :log file after running "run_deltagllb_lapw". You will probably see something different from but similar to: > (run_lapw) options: -deltaglib -i 1 -NI ... (x) lapw2 -all .6936650084 .6937750084
  ...
  
   But as per the userguide (page 58), next I tried "x lapw2 -all X Y" and it crashed.   
 
   [ADC at login2 MgO]$ x lapw2 -all X Y
 forrtl: severe (64): input conversion error, unit 5, file /MgO/MgO.in2
 Image              PC                Routine            Line        Source
 lapw2              00000000004888FE  Unknown               Unknown  Unknown
 lapw2              00000000004B1648  Unknown               Unknown  Unknown
 lapw2              0000000000456579  MAIN__                    330  lapw2_tmp_.F
 lapw2              00000000004046AE  Unknown               Unknown  Unknown
 libc.so.6          00002AAD499612E0  Unknown               Unknown  Unknown
 lapw2              00000000004045AA  Unknown               Unknown  Unknown
 0.005u 0.017s 0:00.04 25.0%     0+0k 32520+16io 94pf+0w
 error: command   /home/software/Build_WIEN2k_18.2_M01/bin/lapw2 lapw2.def   failed
    
 
 
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