modified on 9 August 2018 at 09:43 ••• 145,587 views

Release66:NWChem Documentation

From NWChem

(Difference between revisions)
Jump to: navigation, search
(NWChem 6.6 User Documentation)
 
(9 intermediate revisions not shown)
Line 1: Line 1:
__NOTITLE__
__NOTITLE__
-
=NWChem 6.6 User Documentation=
 
-
A PDF version will be available
+
 
 +
 
 +
<pre  style="font-weight:bold;font-size:200%;color:red">  WARNING: The most up to date documentation can be found on Github at the following url </pre>
 +
==https://github.com/nwchemgit/nwchem/wiki==
 +
 
 +
 
 +
 
 +
 
 +
== NWChem 6.6 User Documentation ('''OBSOLETE''') ==
 +
 
 +
A PDF version of the [http://www.nwchem-sw.org/download.php?f=NWChem6.6_Documentation.pdf Documentation pages is available.]
[[Release66:Overview|'''Overview''']]
[[Release66:Overview|'''Overview''']]

Latest revision as of 09:43, 9 August 2018



  WARNING: The most up to date documentation can be found on Github at the following url 

https://github.com/nwchemgit/nwchem/wiki

NWChem 6.6 User Documentation (OBSOLETE)

A PDF version of the Documentation pages is available.

Overview

System Description

Quantum Mechanical Methods

Quantum Molecular Dynamics

Molecular Mechanics

Hybrid Approaches

Potential Energy Surface Analysis

Electronic Structure Analysis

Other Capabilities

Examples

Supplementary Information