##### LANGUAGES
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# Main Page

(Difference between revisions)
 Revision as of 16:17, 9 August 2010 (view source)Niri (Talk | contribs)← Older edit Revision as of 16:22, 9 August 2010 (view source)Niri (Talk | contribs) Newer edit → Line 52: Line 52: *'''Quantum Mechanical Theories''' *'''Quantum Mechanical Theories''' - **[[SCF|Hartree-Fock or Self-consistent Field]] + **[[SCF|Hartree-Fock Theory]] **[[DFT|Density Functional Theory (DFT) for Molecules]] **[[DFT|Density Functional Theory (DFT) for Molecules]] **[[NWPW|Plane-Wave Density Functional Theory (plane-wave DFT)]] **[[NWPW|Plane-Wave Density Functional Theory (plane-wave DFT)]]

## Revision as of 16:22, 9 August 2010

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## NWChem

ASCIIMath4Wiki: <asciimath>15^2 + 10 = sqrt55225</asciimath>
Cite/Refbase: [1]

pchart4mw: INCOMPATIBLE WITH ASCIIMathWiki (I think I may have fixed that, Huub)

0 <asciimath>1/(1+exp(1+a))</asciimath>

$\beta\,\!$

$\acute{a} \grave{a} \hat{a} \tilde{a} \breve{a}$

$\nabla \, \partial x \, dx \, \dot x \, \ddot y\, dy/dx\, \frac{dy}{dx}\, \frac{\partial^2 y}{\partial x_1\,\partial x_2}$

Preface

Documentation

• Quantum Mechanical Theories

## References

1. Valiev, M.; Bylaska, E.J.; Govind, N.; Kowalski, K.; Straatsma, T.P.; Van Dam, H.J.J.; Wang, D.; Nieplocha, J.; Apra, E.; Windus, T.L.; de Jong, W.A. (2010). "NWChem: A comprehensive and scalable open-source solution for large scale molecular simulations". Computer Physics Communications 181: 1477-1489. doi:10.1016/j.cpc.2010.04.018. ISSN 0010-4655.