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Full-Text Articles in Science and Mathematics Education
A Unique, Project-Based, Microcourse To Teach The Fundamental Concepts Of Quantum Mechanics, Elijah Begin
A Unique, Project-Based, Microcourse To Teach The Fundamental Concepts Of Quantum Mechanics, Elijah Begin
Honors Theses
Spyder, a Scientific Python Development Environment, provides an easy-to-use software that can be used to generate data from quantum mechanical systems. This project proposes and explores a microcourse which takes advantage of this utility to teach undergraduates the fundamentals of quantum mechanics.
Solvation Of Isoelectronic Halide And Alkali Metal Ions By Noble Gas Atoms, Carly A. Rock
Solvation Of Isoelectronic Halide And Alkali Metal Ions By Noble Gas Atoms, Carly A. Rock
Honors Theses
Alkali metal cations (M+ = Li+, Na+, K+, and Rb+), as well as their corresponding isoelectronic atomic anions (X− = H−, F−, Cl−, and Br−) were solvated with argon atoms (i.e., M+Arn and X−Arn where n=1−6). Full geometry optimizations were performed using the MP2 electronic structure method with a series of correlation consistent basis sets augmented with diffuse functions on argon and the anions (aug-cc-pVXZ) and weighted core valence basis sets were used for the cations (cc-pwCVXZ) that include the appropriate pseudopotentials for K+ and Rb+ (cc-pwCVXZ-PP). The basis sets for a particular cluster are, hereafter, simply denoted as XZ …