Thermodynamics of thermal methods for rapid screening of combinatorial libraries
文献信息
Michael J. Blandamer, Paul M. Cullis, Peter T. Gleeson
General equations are developed relating the dependence of temperature on time for a closed system undergoing chemical reaction. Equations are reported for thermally insulated systems and for systems where Newton's law of cooling describes the exchange of thermal energy between system and surroundings. These equations provide the basis for analysing and modelling thermal methods for screening combinatorial libraries. Key equations describe the impact of chemical reactions having different orders and molecularities. The potential of resulting differential equations is illustrated using numerical integration to yield temperature–time plots which highlight the roles of rate constants and enthalpies of reactions.
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Physical Chemistry Chemical Physics

Physical Chemistry Chemical Physics (PCCP) is an international journal co-owned by 19 physical chemistry and physics societies from around the world. This journal publishes original, cutting-edge research in physical chemistry, chemical physics and biophysical chemistry. To be suitable for publication in PCCP, articles must include significant innovation and/or insight into physical chemistry; this is the most important criterion that reviewers and Editors will judge against when evaluating submissions. The journal has a broad scope and welcomes contributions spanning experiment, theory, computation and data science. Topical coverage includes spectroscopy, dynamics, kinetics, statistical mechanics, thermodynamics, electrochemistry, catalysis, surface science, quantum mechanics, quantum computing and machine learning. Interdisciplinary research areas such as polymers and soft matter, materials, nanoscience, energy, surfaces/interfaces, and biophysical chemistry are welcomed if they demonstrate significant innovation and/or insight into physical chemistry. Joined experimental/theoretical studies are particularly appreciated when complementary and based on up-to-date approaches.












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