[Wien] Good RK Max

2018-03-13 Thread Lalit Mohan
during optimization i am getting following error. can you tell me what is the good rkmax for PdH. ERROR status in PdH_vol___-3.00 > stop error (standard_in) 1: syntax error (standard_in) 1: syntax error (standard_in) 1: syntax error (standard_in) 1: syntax error (standard_in) 1: syntax error (st

[Wien] Error in Commandline: x lapw1 -band

2018-03-12 Thread Lalit Mohan
During execution of band structure task at command x lapw1 -band i am getting following message Commandline: *x lapw1 -band * Program input is: *""* At line 75 of file modules_tmp_.F (unit = 5, file = 'root.in1c') Fortran runtime error: End of file 0.003u 0.000s 0:00.00 0.0% 0+0k 0+0io 0pf+0

[Wien] error in calculation of eigen value

2018-03-07 Thread Lalit Mohan
My version is 7.1 During execution of band structure task at command x lapw1 -band i am getting following message Commandline: *x lapw1 -band * Program input is: *""* At line 75 of file modules_tmp_.F (unit = 5, file = 'root.in1c') Fortran runtime error: End of file 0.003u 0.000s 0:00.00 0.0%