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NIST site provides chemical and physical property data on over 40,000 compounds.
InChIKey  ionization potential  IR spectrum  Vis spectrum 
webbook.nist.gov - 2009-03-10
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Thermo-Calc Software is the leading supplier of software, databases and services for technical calculations involving thermodynamics or diffusion. We ...
Diffusion data  Diffusion databases  Materialsgenome  TC-API  TC-PI  Thermochemical databases  Thermodynamic databases  TQ-Interface 
www.materialsgenome.com - 2009-02-04
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