955 resultados para Chemistry Education
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The Frobenius solution to Legendre/s equation is developed in detail as is Rodrigue's formula, which is employed to normalize Legendre polynomials.
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The difficulties of applying the Hartree-Fock method to many body problems is illustrated by treating Helium's electrons up to the point where tractability vanishes. Second, the problem of applying Hartree-Fock methods to the helium atom's electrons, when they are constrained to remain on a sphere, is revisited. The 6-dimensional total energy operator is reduced to a 2-dimensional one, and the application of that 2-dimensional operator in the Hartree-Fock mode is discussed.
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The Frobenius solution to the differential equations associated with the harmonic oscillator (QM) is carried out in detail.
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The continued fraction method for solving differential equations is illustrated using three famous differential equations used in quantum chemistry.
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Quantum Chemistry is usually carried out using Atomic Units, so a careful discussion of these units is warranted.
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This is an introduction to electrostatics written for those interested in dipole moments, induced dipole moments, etc..
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Euler's angles are used to describe rotation using independent coordinates. They are useful in rotation spectroscopy studies, hence this introduction.
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This is a corrected version of the Phys. Rev. A 74,14501 (2006) article. The result is improved slightly from that in the original paper.
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The Huckel Molecular Orbtial method is used to treat the MO's of butadiene. The method employs analytical tools and Maple.
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The explicit formulas for following the passage to chemical equilibrium are derived.
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This is a set of P. Chem. problems posed at slightly higher than the normal text book level, for students who are continuing in the study of this subject.
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Helium Hamiltonian transformations are discussed in extreme detail.
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These readings are a compendium of earlier works put together and corrected for errors. The subject is solution thermodynamics, based on the one dimensional binary solution as "extended" to three dimensions.
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One component systems are treated from the point of view of the Gibbs' phase rule.
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A scheme is introduced which allows computer readable multiple choice forms used in traditional examinations to be employed for constructed response items.