That is super easy, use excel or write code in matlab to generate CNT bundle XYZ file from a single CNT XYZ coordinate file. If need help, let me know.
I want to have a bundle of four CNT (as attached) that should be periodic in x-y plane. but nanotube modeler didn't give me the dimension of the simulation box.
could you please guide me?
do you have the code that you said? if yes, please share with me.
I don't know the coordinate of cnt centers! I use a perl program to generating four cnt. and my problem is about the periodicity of the membrane, it's not properly packed the x-y plane (see attached) because of the dimension of the simulation box.
I don't know how to choose the simulation box to properly generate the periodic membrane.