Pratik Kumar Das

2 Questions 5 Answers 0 Followers

Questions related from Pratik Kumar Das

How to convert a conventional cell to a primitive cell.....?

I am working on 28 atom system. I need a primitive cell with 7 atoms. How should I get a primitive cell or primitive lattice vectors for this structure? I have the .cif file. Is there any way to...

05 March 2017 6,296 7 View

How to calculate piezoelectric tensor in quantum espresso?

I want to calculate the piezoelectric tensor of a material. Is there any possible ways to calculate it through Quantum Espresso? Any suggestion is welcome.Thanks in advance.

13 February 2017 9,865 0 View