Mousam Charan Sahu

2 Questions 3 Answers 0 Followers

Questions related from Mousam Charan Sahu

Band decomposed charge density using quantum espresso ?

Dear sir/mam Greetings for the day ! (1). I am using quantum espresso(QE) to calculate band decomposed charge density. To my knowledge, the kpoint at which we want to calculate the charge...

22 August 2020 1,297 2 View

Out of memory issue in VASP.

Dear VASP users, I am currently learning the band and DOS calculation using VASP. I want to calculate the band and DOS of a 3x3x2 supercell having 180 atoms. But the VASP code showing the issue...

01 January 1970 1,470 3 View