QuantumATK Forum

QuantumATK => General Questions and Answers => Topic started by: aknair on June 28, 2024, 17:15

Title: Green-Kubo Equilibrium Molecular Dynamics
Post by: aknair on June 28, 2024, 17:15

Is there a way to calculate thermal conductivity in ATK using the Green-Kubo Equilibrium Molecular Dynamics Technique?

Title: Re: Green-Kubo Equilibrium Molecular Dynamics
Post by: Anders Blom on July 30, 2024, 00:12

Planned new feature in future version!