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1

Dear

I am a Chinese graduate student and am writing to ask something in Lammps. I plan to use the software in my research, which requires to investigate the influence of platinum’s cavity and oxidation on its electric conductivity. Do you think Lammps can be used as a molecular dynamics tool for calculating these? Thanks.

Best regards,
Lei Wang

2

My advice is to look into the literature to see

if classical MD has been used to model these effects.

If so, then you can look into what LAMMPS commands

will invoke the necessary MD options.

Steve