National Technical Reports Library

The National Technical Information Service acquires, indexes, abstracts, and archives the largest collection of U.S. government-sponsored technical reports in existence. The NTRL offers online, free and open access to these authenticated government technical reports. Technical reports and documents in its repository may be available online for free either from the issuing federal agency, the U.S. Government Publishing Office’s Federal Digital System website, or through search engines.

Details

Gas-Expanded Liquids: Synergism of Experimental and Computational Determinations of Local Structure.

DE2007910459

Publication Date	2007
Personal Author	Eckert, C. A.; Liotta, C. L.; Harnandez, R.
Page Count	14
Abstract	This project focuses on the characterization of a new class of solvent systems called gas expanded liquids (GXLs), targeted for green-chemistry processing. The collaboration has adopted a synergistic approach combining elements of molecular dynamics (MD) simulation and spectroscopic experiments to explore the local solvent behavior that could not be studied by simulation or experiment alone.
Keywords	Solvents Synergy Molecular dynamics Computations Simulation Spectroscopy Gas expanded liquids (GXLs) Green-chemistry processing
Source Agency	Technical Information Center Oak Ridge Tennessee
Corporate Authors	Georgia Inst. of Tech., Atlanta.; Department of Energy, Washington, DC.
Supplemental Notes	Sponsored by Department of Energy, Washington, DC.
Document Type	Technical Report
NTIS Issue Number	200802
Contract Number	DE-FG02-04ER15521

Gas-Expanded Liquids: Synergism of Experimental and Computational Determinations of Local Structure.

Gas-Expanded Liquids: Synergism of Experimental and Computational Determinations of Local Structure.
DE2007910459

Publication Date	2007
Personal Author	Eckert, C. A.; Liotta, C. L.; Harnandez, R.
Page Count	14
Abstract	This project focuses on the characterization of a new class of solvent systems called gas expanded liquids (GXLs), targeted for green-chemistry processing. The collaboration has adopted a synergistic approach combining elements of molecular dynamics (MD) simulation and spectroscopic experiments to explore the local solvent behavior that could not be studied by simulation or experiment alone.
Keywords	Solvents Synergy Molecular dynamics Computations Simulation Spectroscopy Gas expanded liquids (GXLs) Green-chemistry processing
Source Agency	Technical Information Center Oak Ridge Tennessee
Corporate Authors	Georgia Inst. of Tech., Atlanta.; Department of Energy, Washington, DC.
Supplemental Notes	Sponsored by Department of Energy, Washington, DC.
Document Type	Technical Report
NTIS Issue Number	200802
Contract Number	DE-FG02-04ER15521