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Direct linkSimeon, Tomekia; Aikens, Christine M.; Tejerina, Baudilio; Schatz, George C. – Journal of Chemical Education, 2011
The Northwestern University Initiative for Teaching Nanosciences (NUITNS) at nanohub.org Web site combines several tools for doing electronic structure calculations and analyzing and displaying the results into a coordinated package. In this article, we describe this package and show how it can be used as part of an upper-level quantum chemistry…
Descriptors: Chemistry, Engineering, Teaching Methods, Computation
