ESTIMATION OF PURE-COMPONENT PROPERTIES FROM GROUP-CONTRIBUTIONS
Kevin G. Joback, Robert Cortas Reid
Abstract
Kevin G. Joback, Robert Cortas Reid
Abstract
Simple group-contribution methods are proposed to estimate eleven important physical properties of pure materials. A common set of structural groups was employed. High accuracy is not claimed, but the proposed methods are often as accurate as or more accurate than techniques in common use today.
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Simple group-contribution methods are proposed to estimate eleven important physical properties of pure materials. A common set of structural groups was employed. High accuracy is not claimed, but the proposed methods are often as accurate as or more accurate than techniques in common use today.
Key concepts: Component (thermodynamics), Group (periodic table), Simple (philosophy), Set (abstract data type), Group structure, Group contribution method, Computer science, Biological system