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Search Publications by: Vladimir Diky (Fed)

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Displaying 101 - 125 of 197

Extension of ThermoML: The IUPAC Standard for Thermodynamic Data Communications (IUPAC Recommendations 2011)

September 7, 2011
Author(s)
Michael D. Frenkel, Robert D. Chirico, Vladimir Diky, Paul L. Brown, John H. Dymond, Robert N. Goldberg, Anthony R. Goodwin, Heiko Heerklotz, Erich Koenigsberger, John E. Ladbury, Kenneth N. Marsh, David P. Remeta, Stephen E. Stein, William A. Wakeham, Peter A. Williams
ThermoML is an XML-based approach for storage and exchange of experimental, predicted, and critically evaluated thermophysical and thermochemical property data. Extensions to the ThermoML schema for the representation of speciation, complex equilibria, and

Thermodynamic properties of adamantane revisited

August 2, 2011
Author(s)
Vladimir Diky, Ala B. Bazyleva, Andrey V. Blokhin, Gennady J. Kabo, Mikhail B. Charapennikau, Vladimir N. Emel'yanenko, Sergey P. Verevkin
The heat capacity and parameters of the solid-to-solid phase transition of adamantane were measured in the temperature range (80 to 370) K using adiabatic calorimetry. The thermodynamic functions for the compound in the crystalline and liquid states were

Gas Hydrate Research Database and Options for Data Exchange

July 21, 2011
Author(s)
Kenneth G. Kroenlein, Chris D. Muzny, Vladimir Diky, Robert D. Chirico, Michael D. Frenkel, E. D. Sloan
To facilitate advances in application of technologies pertaining to gas hydrates, a freely available data resource containing experimentally derived information about those materials was developed. This database is primary focused on thermophysical

A New Method for Evaluation of UNIFAC Interaction Parameters

July 1, 2011
Author(s)
Jeongwon Kang, Vladimir Diky, Robert D. Chirico, Joe W. Magee, Chris Muzny, Ilmutdin M. Abdulagatov, Andrei F. Kazakov, Michael D. Frenkel
A new method for obtaining UNIFAC group-group interaction parameters is proposed using evaluated thermophysical property data generated at the Thermodynamics Research Center (TRC) of the National Institute of Standards and Technology (NIST). Using the

ThermoData Engine (TDE): Software Implementation of the Dynamic Data Evaluation Concept. 6. Dynamic Web-based Data Dissemination through the NIST Web Thermo Tables

April 26, 2011
Author(s)
Kenneth G. Kroenlein, Chris D. Muzny, Vladimir Diky, Andrei F. Kazakov, Robert D. Chirico, Joe W. Magee, Ilmutdin M. Abdulagatov, Michael D. Frenkel
ThermoData Engine (TDE) is the first full-scale software implementation of the dynamic data evaluation concept, as reported recently in this journal. In the present paper, we describe the development of a World Wide Web-based interface to TDE evaluations

NIST/TRC Web Thermo Tables (WTT) NIST Standard Reference Subscription Database 2 - Lite Edition Version 2

April 4, 2011
Author(s)
Kenneth G. Kroenlein, Chris D. Muzny, Vladimir Diky, Robert D. Chirico, Joe W. Magee, Ilmutdin M. Abdulagatov, Michael D. Frenkel
This NIST standard reference web subscription database provides access to more than 50 thermophysical and thermochemical property data and their uncertainties, critically evaluated for 150 commonly-used pure chemical compounds. The majority of these data

NIST/TRC Web Thermo Tables (WTT) NIST Standard Reference Subscription Database 3 - Professional Edition Version 2

April 4, 2011
Author(s)
Kenneth G. Kroenlein, Chris D. Muzny, Andrei F. Kazakov, Vladimir Diky, Robert D. Chirico, Joe W. Magee, Ilmutdin M. Abdulagatov, Michael D. Frenkel
This NIST standard reference web subscription database provides access to more than 50 thermophysical and thermochemical property data and their uncertainties, critically evaluated for more than 23,000 pure chemical compounds. The majority of these data

Equations of State on Demand: Application for Surrogate Fuel Development

January 15, 2011
Author(s)
Marcia L. Huber, Thomas J. Bruno, Robert D. Chirico, Vladimir Diky, Andrei F. Kazakov, Eric W. Lemmon, Chris D. Muzny, Michael D. Frenkel
The NIST ThermoData Engine (TDE) is a large electronic database containing experimental data with detailed descriptions of relevant metadata and uncertainties that incorporates expert- system software to automatically generate dynamically evaluated data

ThermoML an XML-based Approach for Storage and Exchange of Experimental and Critically Evaluated Thermophysical and Thermochemical Property Data. 5. Speciation and Complex Equilibria

January 7, 2011
Author(s)
Michael D. Frenkel, Vladimir Diky, Robert D. Chirico, Robert N. Goldberg, Heiko Heerklotz, John E. Ladbury, David P. Remeta, John H. Dymond, Anthony R. Goodwin, Kenneth N. Marsh, William A. Wakeham, Stephen E. Stein, Paul L. Brown, Erich Koenigsberger, Peter A. Williams
ThermoML is an XML-based approach for storage and exchange of experimental and critically evaluated thermophysical and thermochemical property data. Extensions to the ThermoML schema for the representation of speciation and complex equilibria are described

ThermoData Engine (TDE): Software Implementation of the Dynamic Data Evaluation Concept. 5. Experiment Planning and Product Design

December 17, 2010
Author(s)
Vladimir Diky, Robert D. Chirico, Andrei F. Kazakov, Chris Muzny, Joe W. Magee, Ilmutdin M. Abdulagatov, Jeon-Hong Kang, Kenneth Kroenlein, Michael D. Frenkel
ThermoData Engine (TDE) is the first full-scale software implementation of the dynamic data evaluation concept, as reported recently in this journal. In the present paper we describe the first steps in implementation of an algorithmic approach to assist

Quality Assessment Algorithm for Vapor-Liquid Equilibrium Data

July 6, 2010
Author(s)
Jeongwon Kang, Vladimir Diky, Robert D. Chirico, Joe W. Magee, Chris D. Muzny, Ilmutdin M. Abdulagatov, Andrei F. Kazakov, Michael D. Frenkel
A quality assessment algorithm for vapor-liquid equilibrium (VLE) data has been developed. The proposed algorithm combines four widely used tests of VLE consistency based on the requirements of the Gibbs-Duhem equation with a check of consistency between