Author Topic: How to construct a molecule on graphene?  (Read 3672 times)

0 Members and 1 Guest are viewing this topic.

Offline Po-Wen

  • New QuantumATK user
  • *
  • Posts: 2
  • Reputation: 0
    • View Profile
How to construct a molecule on graphene?
« on: May 20, 2010, 08:51 »
  ;D ???
Hi everyone!
I am a new user and encounter a fundamental question here:
how can one construct a graphene unit cell with a physisorbed melamine molecule in VNL?
I would appreciate any kinds of suggestion.

Offline youngjfly

  • Heavy QuantumATK user
  • ***
  • Posts: 30
  • Reputation: 0
    • View Profile
Re: How to construct a molecule on graphene?
« Reply #1 on: May 28, 2010, 16:09 »
i am new too.i think it is more convinent to construct the configuration with ATK.
i suggest you read the tutorial of ATK.it is extremly useful most of the time.
You can add any atom and coordinate by using the code.