ADF

Software Summary

Mesabi

Default Module: 

2018.106_intel

Other Modules Available: 

2016.103, 2017.108, 2017.108_cuda, 2017.108_ompi, 2018.014_ompi, 2017.113, 2017.113_cuda, 2018.106_intel_r74086, 2019.102_intel, 2018.106_intel

Last Updated On: 

Tuesday, September 3, 2019

Itasca

Default Module: 

2018.106_intel

Other Modules Available: 

2016.103, 2017.108, 2017.108_cuda, 2017.108_ompi, 2018.014_ompi, 2017.113, 2017.113_cuda, 2018.106_intel_r74086, 2019.102_intel, 2018.106_intel

Last Updated On: 

Tuesday, September 3, 2019

Lab

Default Module: 

2018.106_intel

Other Versions Available: 

2016.103, 2017.108, 2017.108_cuda, 2017.108_ompi, 2018.014_ompi, 2017.113, 2017.113_cuda, 2018.106_intel_r74086, 2019.102_intel, 2018.106_intel

Last Updated On: 

Tuesday, September 3, 2019

Windows

Default Module: 
Other Versions Available: 
Last Updated On: 

Tuesday, September 3, 2019

Web App

Default Version: 
Other Versions Available: 
Last Updated On: 
Last Updated On: 

Tuesday, September 3, 2019

Support Level: 
Secondary Support
Software Access Level: 
Open Access
Software Categories: 
Molecular Modeling and Simulation
Software Description

The molecular ADF program can be applied to gas phase molecules, solvated molecules, and molecules in protein environments. It can treat all elements of the periodic table, and contains state-of-the-art relativistic methods (ZORA and spin-orbit coupling) to treat heavy nuclei.

Software Documentation

Software Documentation Tabs