Yeonsig Nam

3 Questions 1 Answers 0 Followers

Questions related from Yeonsig Nam

PARCHG splitting to spin up and spin down possible?

Hi, this is the second question about charge splitting following the previous one (https://www.researchgate.net/post/How_to_split_charge_density_of_spin_up_down_from_PARCHG_CHGCAR_file_VASP) I...

07 July 2018 2,784 0 View

How can I get brillouin zone of monoclinic lattice?

Hello,, I'm a starter of Material calculations I have a crystal with P21/M (Monoclinic) symmetry group a = 10.5066, b=3.9764, c=5.9548 alpha = 90.00, beta = 96.9631, gamma = 90.00 According to...

03 March 2016 7,603 0 View

Is it possible to perform a molecular dynamics simulation such as ion bombardment using VASP?

I know it is possible to do molecular dynamics but I haven't seen dynamic simulation like ion bombardment. I have googled it but coulnd't find at all... How can i set a velocity and direction of...

02 February 2016 1,960 5 View