TmoleX

Description

TURBOMOLE features all standard and state of the art methods, a very fast DFT code for molecules and solids, excited states and spectra using DFT or Coupled Cluster methods. High accuracy calculations as well as fast and low-scaling algorithms and parallelization allow tackling systems that have been out of reach before.

More information

• Homepage: https://www.3ds.com/products-services/biovia/products/molecular-modeling-simulation/solvation-chemistry/turbomoler/

Availability

Module	NIC5	Hercules2	Dragon2	Lemaitre3	Dragon1
TmoleX/4.5		✓