A Simulation Program for Dynamic Infrared (IR) Spectra

Autor/inn/en	Zoerb, Matthew C.; Harris, Charles B.
Titel	A Simulation Program for Dynamic Infrared (IR) Spectra
Quelle	In: Journal of Chemical Education, 90 (2013) 4, S.506-507 (2 Seiten)Infoseite zur Zeitschrift PDF als Volltext Verfügbarkeit
Sprache	englisch
Dokumenttyp	gedruckt; online; Zeitschriftenaufsatz
ISSN	0021-9584
DOI	10.1021/ed3006852
Schlagwörter	Science Instruction; College Science; Chemistry; Spectroscopy; Kinetics; Computer Assisted Instruction; Computer Simulation; Educational Technology + Suchen Sie Ihr Suchwort? Teaching of science; Science education; Natural sciences Lessons; Naturwissenschaftlicher Unterricht; Chemie; Spektroskopie; Kinetik; Computer based training; Computerunterstützter Unterricht; Computergrafik; Computersimulation; Unterrichtsmedien
Abstract	A free program for the simulation of dynamic infrared (IR) spectra is presented. The program simulates the spectrum of two exchanging IR peaks based on simple input parameters. Larger systems can be simulated with minor modifications. The program is available as an executable program for PCs or can be run in MATLAB on any operating system. Source code is also provided to encourage computer coding projects based on the program. The program is useful for upper-division undergraduates and demonstrates several important concepts from physical chemistry. Example exercises based on the program are included. (As Provided).
Anmerkungen	Division of Chemical Education, Inc and ACS Publications Division of the American Chemical Society. 1155 Sixteenth Street NW, Washington, DC 20036. Tel: 800-227-5558; Tel: 202-872-4600; e-mail: eic@jce.acs.org; Web site: http://pubs.acs.org/jchemeduc
Erfasst von	ERIC (Education Resources Information Center), Washington, DC
Update	2017/4/10