Hello everyone. I'm new to molecular dynamics and don't have enough knowledge of LAMMPS. I want to do a tensile test of graphene - GaN nanosheet. I have the data file of the sheet and I'm using tersoff potential. Can anyone help me with any resource on creating the input file? I've seen the lammps online documentation but it was only done for a single material. Thanks.
Are you creating the whole input file, or already have one and wanna modify? Also wanna add: tersoff's one is most suitable while dealing with thermal conductivity of graphene based materials. Let me know the details
Thanks for the reply and sorry for my late response. I'm using an existential an input and file and I want to modify it for graphene-GaN. I'm providing the input file here. Would the pair coefficients be different for this setting ? Thanks in advance Muhibur Rahaman Fuadh
Did you find what's needed to be changed in the input file for graphene - GaN Muhibur Rahaman Fuadh ??
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