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Michael Woodcox, Sarah Evans, Rebecca Bone, Spencer Mattes, Avik Mahata, Aaron Hagerstrom, Chris Muzny, Ravishankar Sundararaman, Kathleen Schwarz, Angela Stelson
The dielectric response of an ionic solution is determined by the diffusion of ions in solution, the response of solvent molecules and the intermolecular...
Eugene Paulechka, Andrei Kazakov, Chris Muzny, Suphat Watanasiri, Abhijit Dutta
Cycloalkanes and their alkyl derivatives represent a significant fraction of jet fuel components. An evaluation of their thermodynamic properties, enthalpies of...
Gosia Musial, Demian Riccardi, Chris Suiter, Ethan Sontarp, Samantha Miller, Robert Lirette, Kyle Covington-Rehmeier, Avik Mahata, Chris Muzny, Angela Stelson, Kathleen Schwarz, Jason A. Widegren
The balance between ion solvation and ion pairing in aqueous solutions modulates chemical and physical processes from catalysis to protein folding. Yet, despite...
Demian Riccardi, Ala Bazyleva, Eugene Paulechka, Vladimir Diky, Josepha W Magee, Andrei F Kazakov, Scott A Townsend, Chris D Muzny
ThermoML is an XML-based IUPAC standard for the storage and exchange of experimental thermophysical and thermochemical property data. The ThermoML archive is a subset of Thermodynamics Research Center
Vladimir Diky, Ala Bazyleva, Eugene Paulechka, Andrei F. Kazakov, Chris D. Muzny, Robert D. Chirico, Kenneth Kroenlein, Joseph W. Magee, Michael Frenkel
This web application provides free and open access for the broader research community to the experimental planning utilities that are incorporated into ThermoData Engine (TDE) [J. Chem. Inf. Model
Vladimir Diky, Ala Bazyleva, Eugene Paulechka, Andrei F. Kazakov, Chris D. Muzny, Robert D. Chirico, Kenneth Kroenlein, Joseph W. Magee, Michael Frenkel
The ThermoData Engine fully implements all major principles of the concept of dynamic data evaluation formulated at NIST's Thermodynamics Research Center (TRC). Dynamic data evaluation relies on large