Modern fourier transform infrared spectroscopy:
Gespeichert in:
| Hauptverfasser: | , , |
|---|---|
| Format: | Buch |
| Sprache: | English |
| Veröffentlicht: |
Amsterdam [u.a.]
Elsevier
2001
|
| Ausgabe: | 1. ed. |
| Schriftenreihe: | Wilson and Wilson's Comprehensive analytical chemistry
35 |
| Schlagworte: | |
| Online-Zugang: | Inhaltsverzeichnis |
| Beschreibung: | Includes bibliographical references and index |
| Beschreibung: | XX, 356 S. Ill., graph. Darst. |
| ISBN: | 0444500448 |
Internformat
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| 100 | 1 | |a Christy, Alfred A. |e Verfasser |4 aut | |
| 245 | 1 | 0 | |a Modern fourier transform infrared spectroscopy |c Alfred A. Christy ; Yukihiro Ozaki ; Vasilis G. Gregoriou |
| 250 | |a 1. ed. | ||
| 264 | 1 | |a Amsterdam [u.a.] |b Elsevier |c 2001 | |
| 300 | |a XX, 356 S. |b Ill., graph. Darst. | ||
| 336 | |b txt |2 rdacontent | ||
| 337 | |b n |2 rdamedia | ||
| 338 | |b nc |2 rdacarrier | ||
| 490 | 1 | |a Wilson and Wilson's Comprehensive analytical chemistry |v 35 | |
| 500 | |a Includes bibliographical references and index | ||
| 650 | 7 | |a Fourier-spectrometrie |2 gtt | |
| 650 | 7 | |a Infraroodspectrometrie |2 gtt | |
| 650 | 4 | |a Fourier transform infrared spectroscopy | |
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| 700 | 1 | |a Ozaki, Yukihiro |e Verfasser |4 aut | |
| 700 | 1 | |a Gregoriou, Vasilis G. |e Verfasser |4 aut | |
| 830 | 0 | |a Wilson and Wilson's Comprehensive analytical chemistry |v 35 |w (DE-604)BV000900805 |9 35 | |
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Datensatz im Suchindex
| _version_ | 1804129241895272448 |
|---|---|
| adam_text | Contents
Series Editor s Preface............................xvii
Acknowledgements.............................xviii
Authors Preface................................xix
Chapter 1. Electromagnetic radiation and the electromagnetic spectrum .... 1
1.1 Wave nature of electromagnetic radiation—wave characteristics
and wave parameters.........................2
1.2 Quantum concept and particle nature of electromagnetic
radiation...............................6
1.3 Units of wave parameters......................7
1.4 Origin of electromagnetic radiation and electromagnetic
spectrum: y-rays to microwave....................7
General bibliography............................9
Chapter 2. Interaction of electromagnetic radiation with matter.......... 11
2.1 Absorption of electromagnetic radiation.............. 11
2.2 Presentation of data: a line spectrum............... 12
2.3 Line broadening in infrared absorption spectrometry....... 13
2.4 Measured spectra of diatomic molecules.............. 15
2.5 Normal or fundamental vibrations................. 15
2.6 Infrared spectrum of polyatomic molecules............ 17
General bibliography........................... 18
Chapter 3. Theory of infrared spectroscopy...........................19
3.1 Principles of infrared spectroscopy.................19
3.2 Characteristics of infrared spectroscopy..............22
3.3. Molecular vibrations........................23
3.4 A vibration of a diatomic molecule.................23
3.5 Quantum mechanical treatment of a vibration of a diatomic
molecule...............................27
3.6 Vibrations of polyatomic molecules.................29
3.7 Quantum mechanical treatment of vibrations of polyatomic
molecules..............................31
3.8 Anharmonicity............................33
3.9 Overtones and combination modes.................37
3.10 Fermi resonance...........................38
General reading..............................39
Chapter 4. Symmetry of molecules, group theory and its applications in
vibrational spectroscopy.......................................41
4.1 Symmetry of molecules: symmetry elements and symmetry
operations..............................42
4.1.1 Identifying symmetry elements and symmetry operations. 42
4.1.2 Identifying symmetry elements: some examples......51
4.1.3 The classification of molecules, point groups........53
4.2 Group theory and symmetry operations as elements of a group . 56
4.3 Matrix representation of the symmetry operations........59
4.4 Character of the symmetry operations...............64
4.5 Classes of operations........................65
4.6 Reducible and irreducible representations.............70
4.6.1 Irreducible representations and character tables......71
4.6.2 Reducing representations of a point group.........73
4.6.3 Determining characters of operations in Cartesian
representations to obtain reducible representations .... 78
4.7 Application to molecular vibrations................79
4.7.1 Vibrational motion, infrared and Raman spectra......79
4.7.2 Vibrational motions and their symmetries.........80
4.7.3 Wavefunctions representing vibrational motion, and
their symmetries.......................81
4.7.4 Symmetry and infrared absorption.............81
4.7.5 Symmetry and Raman activity................84
4.7.6 Measured spectrum and band assignments.........85
4.8 Examples..............................85
4.8.1 Water and nonlinear molecules with the general formulae
BAB..............................85
4.8.2 Ammonia and pyramidal molecules with the general
formula AB3..........................86
4.8.3 BF3 and planar molecules with formula AX3........88
4.8.4 Planar molecules of lower symmetry with four atoms ... 89
4.8.5 Carbon dioxide and linear molecules with the formula
XYX..............................90
4.8.6 Linear molecules with formula XYZ.............94
4.9 Measured vibrational spectra of molecules............94
4.9.1 More bands due to anharmonicity—overtones and
combination bands......................94
4.9.2 More bands due to Fermi resonance.............95
4.9.3 Overlap of rotational spectrum on vibrational spectrum . . 95
References.................................95
General bibliography...........................96
Chapter 5. Group frequencies and assignments of the infrared bands.....97
5.1 Group frequencies..........................97
5.2 Isotope shift.............................99
5.3 How to make band assignments in infrared spectra.......100
References.................................102
General bibliography...........................103
Chapter 6. Instrumentation......................................105
6.1 History of infrared instrumentation...............105
6.1.1 History of FT-IR instrumentation.............105
6.2 Components of an FT-IR spectrometer..............107
6.2.1 Sources............................ 107
6.2.2 Infrared detectors...................... 109
6.3 Detector noise........................... 112
6.4 Performance of an infrared detector............... 113
6.4.1 MCT detector........................ 114
6.5 Other components......................... 116
6.5.1 Beamsplitters and mirrors................. 116
6.6 Dispersive instruments...................... 117
6.7 Michelson interferometer..................... 118
6.8 Advantages of interferometry................... 120
6.9 Apodization............................. 121
6.10 Resolution............................. 122
6.11 Phase correction.......................... 123
6.13 Effects of mirror misalignment..................124
6.14 Fourier transformation and its use in FT-IR instrumentation . 127
References.................................128
Chapter 7. Sampling techniques and applications....................131
7.1 Transmission spectroscopy....................131
7.1.1 Liquid (solution) samples.................. 134
7.1.2 Powder samples....................... 136
7.1.3 KBr method......................... 136
7.2 Internal and external reflection spectroscopy.......... 136
7.2.1 Attenuated total reflection (ATR) method......... 136
7.2.2 Prisms and accessories for ATR spectroscopy....... 139
7.2.3 Examples of ATR infrared studies............. 141
7.2.4 Reflection-absorption spectroscopy............ 143
7.3 Diffuse reflectance spectroscopy.................. 147
7.4 Photoacoustic spectroscopy.................... 155
7.5 TGA/FT-IR............................. 158
7.6 LC/FT-IR.............................. 172
7.7 GC/FTIR.............................. 180
7.8 SFC/FTIR............................. 182
7.9 Infrared microspectroscopy....................188
7.9.1 FT-IR microscope and redundant aperturing.......188
References.................................190
Chapter 8. Applications of infrared spectroscopy in basic and industrial
research...................................................195
8.1 Polymer applications........................195
8.1.1 Infrared characterization of polymers and polymeric
surfaces...........................195
8.1.2 Phase behaviour of polymer blends [15]..........201
8.1.3 Deuteration studies.....................202
8.1.4 Orientation measurements.................202
8.1.5 Infrared linear dichroism..................203
8.1.6 Dynamic FT-IR procedures.................207
8.1.7 Fourier transform dynamic infrared spectroscopy.....208
8.1.8 Step-scan dynamic FT-IR..................209
8.1.9 Step-scan impulse-response experiments.........210
8.2 Applications to liquid crystals and liquid crystal polymers . . . 211
8.2.1 Dynamic IR spectroscopy of polymers...........212
8.3 Applications to optically active materials.............214
8.3.1 Organic light emitting diodes (OLEDs)..........214
8.3.2 Conducting polymers....................218
8.3.3 Composites and nanocomposites..............218
8.4 Applications to infrared microspectroscopy............222
8.5 Applications to industrial process.................235
8.6 Applications to organic thin films.................236
8.6.1 Infrared spectra of Langmuir-Blodgett films.......236
8.6.2 What we can learn from infrared spectra of LB films . . . 239
8.6.3 Three examples of infrared studies of LB films......243
8.7 Developments in infrared spectroscopy of biological molecules
and materials...........................254
8.7.1 Infrared spectra of proteins.................255
8.7.2 Infrared spectra of chlorophylls..............259
8.7.3 Infrared spectra of a model compound for phospholipids . 260
8.7.4 Infrared spectra of intact bacterial cells..........263
8.7.5 Application of infrared microspectroscopy and imaging
to biological sciences....................265
8.7.6 Structure and function of bacteriorhodopsin studied by
low-temperature infrared difference spectroscopy.....268
8.7.7 Diagnosis of cervical cancer by infrared microspectroscopy
and artificial neural networks...............273
References.................................277
Chapter 9. Modern data analytical methods for infrared spectroscopy .... 285
9.1 Univariate approach in infrared spectroscopy.......... 285
9.2 Multivariate approach in infrared spectroscopy......... 286
9.2.1 The need for multivariate approach and types of
multivariate systems.................... 286
9.2.2 Presentation of data..................... 287
9.2.3 The data matrix X and its decomposition......... 291
9.2.4 Graphic representation of spectral profiles........ 291
9.3 Principal component analysis (PCA)............... 292
9.4 Multivariate calibration...................... 294
9.4.1 Partial least-squares (PLS) calibration.......... 294
9.4.2 An application of multivariate calibration (PLS):
determination of coal maturity (rank)........... 296
9.5 Target projections......................... 300
9.5.1 Understanding the dehydration process and band
assignment of the overtone vibration of the water of
crystallization of calcium oxalate monohydrate...... 302
9.6 Data analysis and resolution by alternating least squares . . . 307
9.6.1 Resolution of infrared spectra and concentration profiles
of the components of a multilayer laminate........ 309
9.6.2 Determination of the equilibrium constant and resolution
of the HOD spectrum by alternating least squares and
infrared analysis...................... 313
9.7 Two-dimensional correlation spectroscopy............ 318
9.7.1 Principle of two-dimensional correlation spectroscopy . . 319
9.7.2 Synchronous and asynchronous correlation spectra. . . . 321
9.7.3 What we can learn from 2D correlation spectroscopy . . . 326
Acknowledgements............................ 329
References................................. 329
Appendix I. Physical constants, conversion factors and atomic masses.... 333
Appendix II. Some character tables and point groups.................335
Appendix III. Matrices..........................................339
Index.....................................351
|
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| indexdate | 2024-07-09T19:02:01Z |
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| language | English |
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| physical | XX, 356 S. Ill., graph. Darst. |
| publishDate | 2001 |
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| publishDateSort | 2001 |
| publisher | Elsevier |
| record_format | marc |
| series | Wilson and Wilson's Comprehensive analytical chemistry |
| series2 | Wilson and Wilson's Comprehensive analytical chemistry |
| spelling | Christy, Alfred A. Verfasser aut Modern fourier transform infrared spectroscopy Alfred A. Christy ; Yukihiro Ozaki ; Vasilis G. Gregoriou 1. ed. Amsterdam [u.a.] Elsevier 2001 XX, 356 S. Ill., graph. Darst. txt rdacontent n rdamedia nc rdacarrier Wilson and Wilson's Comprehensive analytical chemistry 35 Includes bibliographical references and index Fourier-spectrometrie gtt Infraroodspectrometrie gtt Fourier transform infrared spectroscopy FT-IR-Spektroskopie (DE-588)4135416-3 gnd rswk-swf FT-IR-Spektroskopie (DE-588)4135416-3 s DE-604 Ozaki, Yukihiro Verfasser aut Gregoriou, Vasilis G. Verfasser aut Wilson and Wilson's Comprehensive analytical chemistry 35 (DE-604)BV000900805 35 HBZ Datenaustausch application/pdf http://bvbr.bib-bvb.de:8991/F?func=service&doc_library=BVB01&local_base=BVB01&doc_number=009839238&sequence=000002&line_number=0001&func_code=DB_RECORDS&service_type=MEDIA Inhaltsverzeichnis |
| spellingShingle | Christy, Alfred A. Ozaki, Yukihiro Gregoriou, Vasilis G. Modern fourier transform infrared spectroscopy Wilson and Wilson's Comprehensive analytical chemistry Fourier-spectrometrie gtt Infraroodspectrometrie gtt Fourier transform infrared spectroscopy FT-IR-Spektroskopie (DE-588)4135416-3 gnd |
| subject_GND | (DE-588)4135416-3 |
| title | Modern fourier transform infrared spectroscopy |
| title_auth | Modern fourier transform infrared spectroscopy |
| title_exact_search | Modern fourier transform infrared spectroscopy |
| title_full | Modern fourier transform infrared spectroscopy Alfred A. Christy ; Yukihiro Ozaki ; Vasilis G. Gregoriou |
| title_fullStr | Modern fourier transform infrared spectroscopy Alfred A. Christy ; Yukihiro Ozaki ; Vasilis G. Gregoriou |
| title_full_unstemmed | Modern fourier transform infrared spectroscopy Alfred A. Christy ; Yukihiro Ozaki ; Vasilis G. Gregoriou |
| title_short | Modern fourier transform infrared spectroscopy |
| title_sort | modern fourier transform infrared spectroscopy |
| topic | Fourier-spectrometrie gtt Infraroodspectrometrie gtt Fourier transform infrared spectroscopy FT-IR-Spektroskopie (DE-588)4135416-3 gnd |
| topic_facet | Fourier-spectrometrie Infraroodspectrometrie Fourier transform infrared spectroscopy FT-IR-Spektroskopie |
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