Here are some minor fixes and features for vasp_gui.
The file hippuric.qeout is still problematic though. I manage a workaround for gui_vasp, but I think there is something I missed in file_qe.c, related to model->fractional being set to FALSE while core->x[i] are still given in fractional unit...
Anyway, I am now on leave until may 7th (for vacation) but if you find any problem, please let me know.
Hello,
Here are some minor fixes and features for vasp_gui. The file hippuric.qeout is still problematic though. I manage a workaround for gui_vasp, but I think there is something I missed in file_qe.c, related to model->fractional being set to FALSE while core->x[i] are still given in fractional unit...
Anyway, I am now on leave until may 7th (for vacation) but if you find any problem, please let me know.
Sincerely,