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Eckler, Logan H.; Nee, Matthew J. – Journal of Chemical Education, 2016
A simple molecular dynamics experiment is described to demonstrate transport properties for the undergraduate physical chemistry laboratory. The AMBER package is used to monitor self-diffusion in "n"-hexane. Scripts (available in the Supporting Information) make the process considerably easier for students, allowing them to focus on the…
Descriptors: Molecular Structure, Computation, Measurement Techniques, Undergraduate Students
de Morais, Camilo de L. M.; Silva, Se´rgio R. B.; Vieira, Davi S.; Lima, Ka´ssio M. G. – Journal of Chemical Education, 2016
The binding constant and stoichiometry ratio for the formation of iron(II)-(1,10-phenanthroline) or iron(II)-o-phenanthroline complexes has been determined by a combination of a low-cost analytical method using a smartphone and a molecular modeling method as a laboratory experiment designed for analytical and physical chemistry courses. Intensity…
Descriptors: Stoichiometry, Chemistry, Laboratory Experiments, Integrated Activities
Stowe, Ryan; Elvey, Jacob – Science Teacher, 2016
Chemistry in high school is often presented as a jumbled mass of topics drawn from inorganic, analytical, and physical sub-disciplines. With no central theme to build on, students may have trouble grasping the chemical sciences as a coherent field. In this article, Stowe and Elvey describe an activity that integrates different facets of chemistry…
Descriptors: Computer Assisted Design, Chemistry, Biochemistry, Molecular Biology
Albrecht, Birgit – Journal of Chemical Education, 2014
The Wittig reaction is one of the most useful reactions in organic chemistry. Despite its prominence early in the organic chemistry curriculum, the exact mechanism of this reaction is still under debate, and this controversy is often neglected in the classroom. Introducing a simple computational study of the Wittig reaction illustrates the…
Descriptors: Undergraduate Students, Laboratory Experiments, Computation, Organic Chemistry