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Saputra, Andrian; Canaval, Lorentz R.; Sunyono; Fadiawati, Noor; Diawati, Chansyanah; Setyorini, M.; Kadaritna, Nina; Kadaryanto, Budi – Journal of Chemical Education, 2015
Quick and real-time plotting equations using the Winplot software can be employed to create accurate hybrid atomic orbitals without complicated scripting. Performing this task on their own, students can more easily understand and remember hybrid atomic orbitals, in terms of shape and orientation.
Descriptors: Courseware, Task Analysis, Active Learning, Inquiry
Magalha~es, Alexandre L. – Journal of Chemical Education, 2014
The advantages of Gaussian-type orbitals (GTO) over Slater-type orbitals (STO) in quantum chemistry calculations are clarified here by means of a holistic approach. The popular Microsoft Office Excel program was used to create an interactive application with which students are able to explore the features of GTO, including automatic calculations…
Descriptors: Holistic Approach, Quantum Mechanics, Chemistry, Computation

Moore, John W., Ed. – Journal of Chemical Education, 1987
Describes eight applications of the use of computers in teaching chemistry. Includes discussions of audio frequency measurements of heat capacity ratios, quantum mechanics, ab initio calculations, problem solving using spreadsheets, simplex optimization, faradaic impedance diagrams, and the recording and tabulation of student laboratory data. (TW)
Descriptors: Chemistry, College Science, Computer Assisted Instruction, Computer Simulation