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A fully three-dimensional finite element method calculation for the vibrational levels of H2O and D2O

✍ Scribed by J. J. Soares Neto; Jan Linderberg

Publisher
John Wiley and Sons
Year
1991
Tongue
English
Weight
551 KB
Volume
12
Category
Article
ISSN
0192-8651

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✦ Synopsis

Abstract

A finite element method approach for solving the three‐dimensional SchrΓΆdinger equation expressed in hyperspherical coordinates is applied to the calculation of rovibrational states of H~2~O and D~2~O. Comparisons to experimental values and other theoretical calculations are offered.

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