[lammps-users] Differences in atom styles

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1

Hi Users,

I was wondering if there is more detail on the atom styles? Mainly, what is the differences in the angle, bond, and full? I’m asking because I’m in the process of designing an MD simulation of a block copolymer with a peptidic block and non-peptidic block.

Is there any documentation that describes the parameters that need to be set for each atom style?

Thanks,
Casey

2

Hi Users,

I was wondering if there is more detail on the atom styles? Mainly, what is
the differences in the angle, bond, and full? I'm asking because I'm in

they store a different amount of properties per atom.

the process of designing an MD simulation of a block copolymer with a
peptidic block and non-peptidic block.

have you looked at this?

which part of this page is difficult for you to understand?

Is there any documentation that describes the parameters that need to be set
for each atom style?

yes. the documentation for the atom_style keyword.

axel.

3

Also see the doc page for the read_data command.
It tells you what different info needs to be in the data
file for different styles.

Steve