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1.
J Chem Inf Model ; 46(6): 2487-93, 2006.
Artigo em Inglês | MEDLINE | ID: mdl-17125189

RESUMO

Thermodynamic data are a key resource in the search for new relationships between properties of chemical systems that constitutes the basis of the scientific discovery process. In addition, thermodynamic information is critical for development and improvement of all chemical process technologies. Historically, peer-reviewed journals are the major source of this information obtained by experimental measurement or prediction. Technological advances in measurement science have propelled enormous growth in the scale of published thermodynamic data (almost doubling every 10 years). This expansion has created new challenges in data validation at all stages of the data delivery process. Despite the peer-review process, problems in data validation have led, in many instances, to publication of data that are grossly erroneous and, at times, inconsistent with the fundamental laws of nature. This article describes a new global data communication process in thermodynamics and its impact in addressing these challenges as well as in streamlining the delivery of the thermodynamic data from "data producers" to "data users". We believe that the prolific growth of scientific data in numerous and diverse fields outside thermodynamics, together with the demonstrated effectiveness and versatility of the process described in this article, will foster development of such processes in other scientific fields.


Assuntos
Química/métodos , Desenho de Fármacos , Revisão da Pesquisa por Pares , Bases de Dados Bibliográficas , Furanos/química , Informática , Cinética , Modelos Químicos , Publicações Periódicas como Assunto , Polímeros/química , Software , Termodinâmica
2.
J Res Natl Bur Stand (1977) ; 88(4): 241-252, 1983.
Artigo em Inglês | MEDLINE | ID: mdl-34566104

RESUMO

An apparatus has been developed for simultaneous measurements of fluid densities and dielectric constants at temperatures from 70 to 320 K and at pressures to 35 MPa. A magnetic suspension technique, based on an application of Archimedes' principle, is employed in the density determination, while a concentric cylinder capacitor is used for obtaining the dielectric constant data. The apparatus can be used not only for determining densities and dielectric constants of compressed gases and liquids (including mixtures), but for saturated liquid and vapor properties as well. Also included is the capability for acquiring liquid-vapor equilibrium data for mixtures. The total uncertainty of a single density measurement is estimated to be approximately 0.1% for densities as low as 50 kg/m3; at lower densities, the uncertainty increases. The imprecision of the density data is typically less than 0.02%. The total uncertainty in the dielectric constants is approximately 0.01%. Experimental data for a 0.85 CH4 + 0.15 C2H6 mixture are given here to demonstrate the performance of the apparatus.

3.
Rev Sci Instrum ; 50(9): 1154-5, 1979 Sep.
Artigo em Inglês | MEDLINE | ID: mdl-18699690

RESUMO

A differential capacitance sensor has been used in the servosystem of a magnetic suspension densimeter to detect the position of a magnetic buoy. This type of sensor has not previously been used in this application. Its design, performance, and advantages are described.

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