Newton-X 2.6-b01-GCCcore-12.3.0

NX is a general-purpose program package for simulating the dynamics of electronically excited molecules and molecular assemblies.

Accessing Newton-X 2.6-b01-GCCcore-12.3.0

To load the module for Newton-X 2.6-b01-GCCcore-12.3.0 please use this command on the BEAR systems (BlueBEAR and BEAR Cloud VMs):

📋 module load bear-apps/2023a
module load Newton-X/2.6-b01-GCCcore-12.3.0

BEAR Apps Version

2023a

Architectures

EL8-cascadelake — EL8-icelake — EL8-sapphirerapids

The listed architectures consist of two part: 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 Newton-X website.

Dependencies

This version of Newton-X has a direct dependency on: GCCcore/12.3.0 Perl/5.36.1-GCCcore-12.3.0

Last modified on 4th September 2024