Siam Quantum 1.2.8

An basic quantum chemistry software
Siam Quantum - Usage example of the Siam Quantum app from the command-line in Ubuntu 12.10
  3 Screenshots
Siam Quantum is an open source command-line software that helps students to better understands electronic structure calculations, supporting both Linux and Windows operating systems.

Siam Quantum is able to calculate restricted MP2 energies of molecules and Hartree-Fock, output high quality results, comparable to the ones from standard quantum chemistry apps, such as GAMESS and Gaussian, perform post SCF calculations, such as molecular orbitals and electron density, simple population  analysis and geometry optimization.

last updated on:
March 26th, 2013, 7:13 GMT
price:
FREE!
homepage:
www.physics.kku.ac.th
license type:
GPL (GNU General Public License) 
developed by:
Khon Kaen University
category:
ROOT \ Science and Engineering \ Chemistry
Siam Quantum
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3 Screenshots
Siam Quantum - Usage example of the Siam Quantum app from the command-line in Ubuntu 12.10Siam Quantum - Usage example of the Siam Quantum app from the command-line in Ubuntu 12.10
What's New in This Release:
  • The Minimum Energy Crossing Point (MECP) can now be calculated.
read full changelog

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