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book: Inverse Problems of Vibrational Spectroscopy
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Inverse Problems of Vibrational Spectroscopy

  • A. G. Yagola , I. V. Kochikov and G. M. Kuramshina
Language: English
Published/Copyright: 1999
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Inverse and Ill-Posed Problems Series

Topics

  • Publicly Available

    Frontmatter

    I
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  • Publicly Available

    Contents

    V
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    Preface

    IX
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    Introduction

    1
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    Chapter 1. Physical model of molecular vibrations

    9
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    Chapter 2. Full statement of the vibrational problem

    27
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    Chapter 3. Consideration of the mathematical model for molecular vibration analysis. Direct and inverse problems

    53
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    Chapter 4. Vibrational problem in internal coordinates. Use of the redundant coordinate system

    71
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    Chapter 5. Vibrational problem in symmetry coordinates

    101
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    Chapter 6. Ill-posed problems and the regularization method. Regularizing algorithms for constructing force fields of polyatomic molecules on the base of experimental data

    125
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    Chapter 7. Numerical methods

    161
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    Chapter 8. Analysis of band intensities in vibrational spectra of polyatomic molecules

    187
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    Chapter 9. Numerical implementation of algorithms for solving problems of vibrational spectroscopy

    205
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    Chapter 10. Examples of molecular force field calculations on the basis of experimental data

    227
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    Chapter 11. Joint treatment of ab initio and experimental data in molecular force field calculations with Tikhonov's method of regularization

    259
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    Appendix Α. Systems of units used in vibrational spectroscopy

    281
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    Bibliography

    289
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Publishing information
Pages and Images/Illustrations in book
eBook published on:
October 16, 2014
eBook ISBN:
9783110943269
Hardcover published on:
July 1, 1999
Hardcover ISBN:
9783110363968
Edition:
Reprint 2014
Pages and Images/Illustrations in book
Front matter:
8
Main content:
297
https://doi.org/10.1515/9783110943269
eBook ISBN: 9783110943269
Hardcover ISBN: 9783110363968
Keywords for this book
Inverses Problem; Partielle Differentialgleichung
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