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Direct linkChoirun Nisaa Rangkuti; Suci Faniandari; A. Suparmi; Yanoar Pribadi Sarwono – Journal of Chemical Education, 2024
As a widely applied theory that has found success across many fields, density functional theory (DFT) is largely taught. Typically, the most effective way to convey DFT concepts is through illustrative examples that are currently lacking in available resources. In this work, we demonstrate total energy calculations for H[subscript 2] using…
Descriptors: Scientific Concepts, Molecular Structure, Science Education, Chemistry
Messersmith, Stephania J. – Journal of Chemical Education, 2014
An upper-division undergraduate chemistry experiment is described which utilizes DigiSim software to simulate cyclic voltammetry (CV). Four mechanisms were studied: a reversible electron transfer with no subsequent or proceeding chemical reactions, a reversible electron transfer followed by a reversible chemical reaction, a reversible chemical…
Descriptors: Undergraduate Study, College Science, Chemistry, Computer Software
Borgsmiller, Karen L.; O'Connell, Dylan J.; Klauenberg, Kathryn M.; Wilson, Peter M.; Stromberg, Christopher J. – Journal of Chemical Education, 2012
A discovery-based method is described for incorporating the concepts of IR and Raman spectroscopy into the general chemistry curriculum. Students use three sets of springs to model the properties of single, double, and triple covalent bonds. Then, Gaussian 03W molecular modeling software is used to illustrate the relationship between bond…
Descriptors: Chemistry, Spectroscopy, Science Instruction, College Science
Gagnon, Michel – Physics Education, 2011
Mainly used in the 1960s, bubble chambers played a major role in particle physics. Now replaced with modern electronic detectors, we believe they remain an important didactic tool to introduce particle physics as they provide visual, appealing and insightful pictures. Sadly, this rare type of detector is mostly accessible through open-door events…
Descriptors: Simulation, Mechanics (Physics), Computer Software, Science Instruction
Download full textGarg, Amit; Sharma, Reena; Dhingra, Vishal – European Journal of Physics Education, 2010
In this paper, we report the development of an automated system for energy bandgap and resistivity measurement of a semiconductor sample using Four-Probe method for use in the undergraduate laboratory of Physics and Electronics students. The automated data acquisition and analysis system has been developed using National Instruments USB-6008 DAQ…
Descriptors: Undergraduate Study, College Science, Science Instruction, Physics
Ovalle, V.; Otomar, D. R.; Pereira, J. M.; Ferreira, N.; Pinho, R. R.; Santos A. C. F. – European Journal of Physics, 2008
This paper describes some computer-based activities to bring the study of charged particle optics to undergraduate students, to be performed as a part of a one-semester accelerator-based experimental course. The computational simulations were carried out using the commercially available SIMION program. The performance parameters, such as the focal…
Descriptors: Computer Simulation, Optics, College Science, Science Experiments
