Pages

Quantum Espresso Series: How to run calculations in Quantum Espresso

I found a blog where nuts and bolts of doing calculations in Quantum Espresso code. In the blog post from quantumbarista.blogspot.com , the author Ryan Cloke has discussed the "Electronic Structure Calculations of Graphene Nanoribbons Using Quantum Espresso".

This blog post provides a detailed description on how to compute the band structure of a graphene nanoribbon.

Have a look at it.

I will do calculations and update to you later.


1 comment:

You may be interested in these posts

Error in image file conversion: convert-im6.q16: not authorized `test.eps' @ error/constitute.c/WriteImage/1037.

This error is because of the vulnerability. This allows remote execution of code using image formats. So, some Linux distributions by defaul...