Solution of the Schrödinger Equation for a Diatomic Oscillator Using Linear Algebra.

• Autores: Zbigniew L. Gasyna
• Localización: Journal of chemical education, ISSN 0021-9584, Vol. 85, Nº 6, 2008, págs. 845-846
• Idioma: inglés
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• Resumen

  • Computational experiment is proposed in which a linear algebra method is applied to the solution of the Schrödinger equation for a diatomic oscillator. Calculations of the vibration�rotation spectrum for the HCl molecule are presented and the results show excellent agreement with experimental data.