%0 Journal Article %1 CJCE:CJCE5450670420 %A Jubb, D. J. A. %A Missen, R. W. %D 1989 %I Wiley Subscription Services, Inc., A Wiley Company %J The Canadian Journal of Chemical Engineering %K derivation %N 4 %P 658--664 %R 10.1002/cjce.5450670420 %T The computer-derivation of thermodynamic equations Part III. Chemical systems %U http://dx.doi.org/10.1002/cjce.5450670420 %V 67 %X An algorithm, THERMODER4, based on Jacobians, is presented for automating the symbolic derivation of expressions for thermodynamic derivatives for chemical systems, to complement algorithms given previously for unrestricted simple and complex systems. The algorithm is implemented by a program using an augmented computer-algebra system together with a microcomputer. Examples are given to illustrate the use of the algorithm in transforming variables and in sensitivity analysis for systems at equilibrium.

@article{CJCE:CJCE5450670420, abstract = {An algorithm, THERMODER4, based on Jacobians, is presented for automating the symbolic derivation of expressions for thermodynamic derivatives for chemical systems, to complement algorithms given previously for unrestricted simple and complex systems. The algorithm is implemented by a program using an augmented computer-algebra system together with a microcomputer. Examples are given to illustrate the use of the algorithm in transforming variables and in sensitivity analysis for systems at equilibrium.}, added-at = {2012-03-01T15:42:58.000+0100}, author = {Jubb, D. J. A. and Missen, R. W.}, biburl = {https://www.bibsonomy.org/bibtex/2711fc9d5fe2ac6f3f2c66907d31693b2/maxj}, description = {The computer-derivation of thermodynamic equations Part III. Chemical systems - Jubb - 2009 - The Canadian Journal of Chemical Engineering - Wiley Online Library}, doi = {10.1002/cjce.5450670420}, interhash = {a914036d7e62e0d100c768fe58962772}, intrahash = {711fc9d5fe2ac6f3f2c66907d31693b2}, issn = {1939-019X}, journal = {The Canadian Journal of Chemical Engineering}, keywords = {derivation}, number = 4, pages = {658--664}, publisher = {Wiley Subscription Services, Inc., A Wiley Company}, timestamp = {2012-03-01T15:42:58.000+0100}, title = {The computer-derivation of thermodynamic equations Part III. Chemical systems}, url = {http://dx.doi.org/10.1002/cjce.5450670420}, volume = 67, year = 1989 }