How to build surface of the silica with alkyl and hydroxyl in lammps?

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1

Dear all
How to build surface of the silica with alkyl and hydroxyl in lammps? Give me some advice,thanks!

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2

Pick your favorite software to build structures and generate the config. Decide on a forcefield for the interactions and put together an input file as required by lammps:
http://lammps.sandia.gov/doc/read_data.html

Carlos