core shell

Dear Sir

I have searched your examples and found in core-shell folder the attached script.

Can you tell me how have you created that data.coreshell file. because I am need to make fe3o4 file also.

data.coreshell (37.9 KB)

in.coreshell (1.98 KB)

Dear Sir

I have searched your examples and found in core-shell folder the attached
script.

Can you tell me how have you created that data.coreshell file. because I
am need to make fe3o4 file also.

​the title line in the header of data.coreshell gives a strong hint:

NaCl_8_molten_333.data (written by ASE) + shell Na x=0.5 (1u3) Volume
Expanded

​ASE refers to "Atomic Simulation Environment", which is easy to find via
google or similar.

axel.​