A big data framework to validate thermodynamic data for chemical species

• Main Authors: Buerger, Philipp, Akroyd, Jethro, Martin, Jacob W., Kraft, Markus
• Other Authors: School of Chemical and Biomedical Engineering
• Format: Article
• Language: English
• Published: 2017
• Subjects: Heat of formation; Enthalpy of formation
• Online Access: https://hdl.handle.net/10356/83222; http://hdl.handle.net/10220/42492
• Institution: Nanyang Technological University

The advent of large sets of chemical and thermodynamic data has enabled the rapid investigation of increasingly complex systems. The challenge, however, is how to validate such large databases. We propose an automated framework to solve this problem by identifying which data are consistent and recom...