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Periodic Table of Parameters

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Description: [Basic] This table lists and describes some well documented and validated parameter sets available for modeling each element by Molecular Mechanics and Quantum Mechanics molecular modeling methods.
Periodic Table of Computational Chemistry This Periodic Table of the Elements serves as a guide to summarize which Force Fields ( ), Semiempirical Parameterizations ( ) have been developed and are documented and available for modeling each element.
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Page title:Periodic Table of Computational Chemistry
Keywords:reference, periodic table, elements, computational, chemistry, chemical, molecular modeling, computational chemistry, molecular, modeling, parameter, basis set, force field, semiempirical, ab initio
Description:Periodic table, showing which Computational Chemistry methods have parameters available for modeling each element.
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Creation Date: 14-jan-1997
Expiration Date: 13-jan-2018