WIEN2k

Description

The program package WIEN2k allows to perform electronic structure calculations of solids using density functional theory (DFT). It is based on the full-potential (linearized) augmented plane-wave ((L)APW) + local orbitals (lo) method, one among the most accurate schemes for band structure calculations. WIEN2k is an all-electron scheme including relativistic effects and has many features.

More information

• Homepage: http://www.wien2k.at/

Availability

Module	NIC5	Hercules2	Dragon2	Lemaitre3	Dragon1
WIEN2k/21.1-intel-2021a		✓