"Don't blame me for my ignorance, I have to have something to learn."
- Bumble B. Bonger, Trantor
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See the Lists Below?
O. K. I will post a picture here to explain how to use the Lists below. Basically, I need to know the spacial relations and energy levels of the Bonding and AntiBonding Molecular Orbitals. Kind of a mash-up of Band Theory and Cooper Pairs.
Foundations of Ambient Temperature Superconductors
The building blocks of Ambient Temperature Superconductors, an investigation into Molecular Orbitals and Structure.I mashed together everything I understand about Quantum Mechanics and General Relativity with as much Crystallography and Condensed Matter Physics along with liberal Ladlings of Mathematics. The Theories of Conductors, Semiconductors and Superconductors focused a direction for this investigation. The picture to the left is unimportant to this investigation, it just looks Cool (truth be told this last statement is somewhat False).
Abundance of elements in Earth's crust - Wikipedia
After further investigation, the models of Molecular Bonds have Hydrogens to maintain the proper filling orders of the Molecular Orbitals of interest. There are two lists. "Molecular Orbital with Hydrogen for Geometry and MO filling" implements JSMol and GAMESS output. "MO Diagrams" will require output from GaussSum and GAMESS output.
GaussSum Version 3.0
Molecular Orbital with Hydrogen for Geometry and MO filling
MO Energy Level Diagrams
H-O-H
H-O-O-H
H3-Si-Si-H3
H3-Si-O-H
H2-Al-Al-H2
H2-Al-O-H
H2-Al-Si-H3
H-H
H-H
H-O-H
H-O-O-H
H3-Si-Si-H3
H3-Si-O-H
H2-Al-Al-H2
H2-Al-O-H
H2-Al-Si-H3
H-H
H-H
Diatomic Species MO theory Chemogenesis
Software to figure this out
- MoCalc2012 download SourceForge.net - an interface
- Stewart Computational Chemistry - MOPAC Home Page
- GaussSum Version 3.0 and the 3 Listed over there ->
- Firefly (formerly PC GAMESS) Home Page
- Main Page - NWChem
(also here) http--timn.ho.ua-ccs- - ORCA • Portal
Give credit where credit is due. This compilation does not cost money. Curiosity feeds on Time.
Avogadro - Free cross-platform molecule editor
- Avogadro: an open-source molecular builder and visualization tool. Version 1.XX. http://avogadro.openmolecules.net/
- Marcus D Hanwell, Donald E Curtis, David C Lonie, Tim Vandermeersch, Eva Zurek and Geoffrey R Hutchison; "Avogadro: An advanced semantic chemical editor, visualization, and analysis platform" Journal of Cheminformatics 2012, 4:17