Jakub Nieścior

5 Questions 12 Answers 0 Followers

Questions related from Jakub Nieścior

Can anyone tell me where I can find AlN interatomic potential co I could use it with LAMMPS?

For some time I have been searching for Al-N interatomic potential so I could do molecular dynamics simulation. Potential I need should give good thermo-mechanic properties of AlN. I found two...

02 February 2015 8,649 4 View

Is Helium-Chromium interatomic potential only repulsive?

I want to conduct molecular static simulation of ferrite-chromium-helium. I want to calculate adhesion of helium on this alloy and I need to choose potential. I found only repulsive potential of...

11 November 2014 4,981 4 View

Did anyone conduct molecular dynamics simulations of symmetric twin boundaries?

I am asking because I can not obtain results from article "Binding of He n V clusters to -Fe grain boundaries" by M.A.Tschopp. I tried to repeat those simulations but I get totally different grain...

10 October 2014 770 6 View

What are Beck potential coefficients for Helium?

Hi there, you helped me a lot so I have another question. I try to conduct Molecular Dynamics simulations of Helium in iron alloy using LAMMPS program. In the documentation are exemplary...

10 October 2014 3,524 0 View

How can I define if grain boundary is melted in molecular dynamic simulations?

I do molecular dynamics simulation of high speed deformation of copper nanowire with grain boundaries. Those boundaries thicken during simulation and I wonder if there nucleate vacancies, they...

09 September 2014 7,310 3 View