Request optimized molecules

LAMMPS LAMMPS Mailing List Mirror
1

Hi
I am a beginner in lammps and need two optimized molecules (DATA file or filename.XYZ)
1- RDX molecule (C3H6N6O6)
2- Stearic acid molecule (C17H35COOH)
please send this files for me

Thanks a lot

2

Hi
I am a beginner in lammps and need two optimized molecules (DATA file or
filename.XYZ)
1- RDX molecule (C3H6N6O6)
2- Stearic acid molecule (C17H35COOH)
please send this files for me

...and i always wanted a pony for christmas.

thanks,
     axel.

3

Which a creative way of saying no one is likely

to create data files of LAMMPS input for you.

Steve

4

There is, however, a data file for RDX in the reax example folder (data.rdx)