SIESTA

(under provided license)

Description

Siesta (Spanish Initiative for Electronic Simulations with Thousands of Atoms) is both a method and its computer program implementation, to perform electronic structure calculations and ab initio molecular dynamics simulations of molecules and solids.

Installations

CTE-AMD:
Versions:
4.1-b4

Nord3:
Versions:
trunk-449
4.1-b2
3.2-pl4
3.2
3.1
3.0.8-ldau
2.0.2