QuantumATK Forum

QuantumATK => General Questions and Answers => Topic started by: bsb_2015 on April 4, 2015, 19:06

Title: Work Function
Post by: bsb_2015 on April 4, 2015, 19:06

Dear All,
How to calculate work function of Grafite and graphene.
Thanks.

Title: Re: Work Function
Post by: kstokbro on April 7, 2015, 21:48

Take a look at this tutorial: http://www.quantumwise.com/publications/tutorials/item/499-computing-the-work-function-of-a-metal-surface-using-ghost-atoms