Sumaiyatul Ahsan

4 Questions 5 Answers 0 Followers

Questions related from Sumaiyatul Ahsan

Why Runge kutta method is applied in MD Simulation (namely LAMMPS) and how can I apply 4th order RK method in LAMMPS?

I want to solve Equation of motions using RK4 in lammps, can this be done using the current lammps commands or do I need to write code? Also what are the benefits of using RK4 instead of verlet...

25 April 2021 3,964 2 View

Where can I find .cif file for Silicene?

I couldn't find the .cif file in COD or Material Project. Space group should be P-3m1 (buckled structure).

25 March 2021 8,023 2 View

How can I convert .vesta file to a .cif file?

I've used the "export data" option in Vesta software to convert my unit cell into a cif file however when I use that cif in atomsk it shows error such as "can't read the position of atom 0". If I...

01 March 2021 5,500 3 View

Correlate between high stress creep simulation with real-life service condition data.

Creep is a time dependent process whereas MD simulation is restrictive in terms of the time scale. Hence to get appreciable strain in fs/ps time range we have to use a stress of GPa magnitude. Can...

01 January 1970 2,374 1 View