DFT-D3 3.2.0-intel-2023a

DFT-D3 implements a dispersion correction for density functionals, Hartree-Fock and semi-empirical quantum chemical methods.

Accessing DFT-D3 3.2.0-intel-2023a

To load the module for DFT-D3 3.2.0-intel-2023a please use this command on the BEAR systems (BlueBEAR and BEAR Cloud VMs):

📋 module load bear-apps/2023a
module load DFT-D3/3.2.0-intel-2023a

BEAR Apps Version

2023a

Architectures

EL8-emeraldrapids — EL8-icelake — EL8-sapphirerapids

The listed architectures consist of two parts: OS-CPU. The OS used is represented by EL and there are several different processor (CPU) types available on BlueBEAR. More information about the processor types on BlueBEAR is available on the BlueBEAR Job Submission page.

More Information

For more information visit the DFT-D3 website.

Dependencies

This version of DFT-D3 has a direct dependency on: intel/2023a

Required By

This version of DFT-D3 is a direct dependent of: WIEN2k/24.1-intel-2023a

Last modified on 16th June 2026