QuantumATK Forum

QuantumATK => General Questions and Answers => Topic started by: debashishdashnits on July 4, 2016, 15:59

Title: DOS and PDOS
Post by: debashishdashnits on July 4, 2016, 15:59

Hello to all,
I am debashish from NIT Silchar.

Can anyone elaborate , what is DOS and PDOS???How to analyze both in ATK?

Title: Re: DOS and PDOS
Post by: Petr Khomyakov on July 4, 2016, 17:29

DOS and PDOS stand for the 'density of states' and 'projected density of states', respectively.

You may have a look, for example, at this introductory tutorial, http://docs.quantumwise.com/tutorials/intro_vnl_atk1.html, to find out how it can be calculated and analyzed.