[Wien] Elastic constants of a surface(2D material)

Dear Wien2k users Can you guide me how i can calculate elastic constants of a surface or two-dimensional materials using Energy approach? With best Amir___ Wien mailing list Wien@zeus.theochem.tuwien.ac.at

[Wien] case.inop output issue [solved] just to inform Dr. Pavel

[Wien] case.inop output issue Thank you Gavin and Pavel It was issue in case.injoint Kind regards Bhamu ___

[Wien] runsp_c_lapw issue [unmatched] >> It seems, it not harmful

Dear Elias Thank you very much for kind and informative response. I do not see that the "unmatched ." message is harmful. See my point by point reply on your question: [Wien] runsp_c_lapw issue [unmatched] not solved even after looking on mailing list

Re: [Wien] runsp_c_lapw issue [unmatched] not solved even after looking on mailing list

On 11/24/2016 08:57 PM, Dr. K. C. Bhamu wrote: > 1. Initialised without any problem. > 2. runsp_lapw -orb -ec 0.0001 -cc 0.0005 -i 2 -fc 2 works fine > but if I run > 3. runsp_c_lapw -orb -ec 0.0001 -cc 0.0005 -i 2 -fc 2 gave me two > problems: > hup: Command not found. > LAPW0 END