Spectroscopy

Chem 2230

Department of Chemistry University of Pittsburgh

 

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Course Description:

In your undergraduate analytical and physical chemistry courses you were exposed to the general principles of measurements and spectroscopic instrumentation. The fundamental atomic and physical properties that one actually measures were probably discussed mostly in your physical chemistry courses, while the measurement and instrumentation issues were discussed in your analytical courses. In Chem 2230, the aim is to develop a more fundamental understanding of spectroscopic processes. We will also focus on some of the key issues in the design of spectroscopic measurements. What is the fundamental process or property to be measured, and why will a particular measurement provide the desired chemical insight? What are the boundary conditions on the measurement? What levels of detection, sensitivity and selectivity are required, and how can they be achieved? What modules (sources, detectors, etc.) should be selected for the measurement? What is the optimum way of doing the experiment (e.g. the time or frequency domain)? Finally, how can the quality of the measurement be assessed, and how can the results be interpreted in terms of chemical processes? Download syllabus here.

 

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Instructor:

Professor Sanford Asher

Room 701 Chevron Science Center

phone: 412-624-8570

email: asher@pitt.edu

Office Hours will be arranged in class and may be scheduled by appointment.

 

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Class Meeting Times:

Tuesday and Thursday from 5:30 p.m.to 7:15 p.m

Room 228, Eberle Hall

First Class: Tuesday, August 26th

Last Class: December 11th (Final Exam)

No Classes: October 2nd, October 9th, October 14th, October 30th, November 13th, and November 27th.

 

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Course Requirements:

 

Required Text:

 

James Ingle and Stanley Crouch, Spectrochemical Analysis (Prentice Hall: NJ); and Daniel Harris & Michael Bertolucci, Symmetry & Spectroscopy (Dover Publications: NY).

These texts will be supplemented by other required reading materials that will be distributed in class or that will be available on reserve in the Chemistry and Computer Science library (Eberly Hall). In particular, much of the material in the last half of the course will be based on the current chemical literature. The books on reserve for this course cover a wide range of material, some of which will help you reinforce areas in which your background may be weak, and others which cover material not included (or not covered adequately) in the required text.

 

Problem Sets:

 

Problem sets will be assigned and collected, checked, but not graded in detail. I expect you to do your homework when it is due and your grade depends upon timely performance. Answer keys will be placed on reserve in the Chemistry library approximately one week after the problem sets are handed out. You are STRONGLY urged to do the problem sets on your own, and to refer to the answer keys only after you have given the assignments your best effort.

 

Grading:

 

There will be three in-class exams, each worth 22.5% of your grade. They will be given on September 30th (Tues.), October 28th (Tues.) and December 11 (Thurs.). Please inform me immediately if you have any conflict with these dates. There will be no make-up exams, but an oral exam will be given if an exam is missed due to serious illness or demonstrated extreme emergency.

Another 22.5% of your grade will be based on a take-home exam about spectroscopic problems described in the chemical literature. Details on this assignment will be distributed early in mid November. The assignment will be due on December 11, 2008. There will be no exceptions.

The remaining 10% of your grade depends upon classroom participation. Some concepts we will cover are difficult. To achieve the intuitive understanding desired, we must discuss the issues and look at them from different view points. Please help! If you don't contribute to the discussion, you will loose points!

 

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Course Outline :

I. General Concepts

  • Wave, wavevector, polarization (linear, circular)
  • Refractive index, dielectric constant
  • Absorption/reflection/refraction
  • Readings: IC ch 1, 2 (S ch. 7; M pp. 361-419)
  • Beer's law (absorption, scattering) emission
  • Notation in quantum mechanics
  • Absorption processes in optical spectroscopy; atomic and molecular energetics
  • Absorption and emission probabilities (intensities, lifetimes, bandshapes)
  • Readings: IC ch. 12; (S ch. 13.3, 15.1-15.2, 16.1-16.4, 19.3; M to be assigned)
II. Experimental Approach: Aspects of Instrumentation
  • Readings: IC ch. 3, 4 (S ch. 8,9)
  • Sources
  • Optical elements, monochromators
  • Detectors
  • Noise, the meaning of results, phase sens. Detection, autocorrelation
  • Readings: IC ch. 5,6, Appendix A; (S ch. 10-12)

Note: The following topics will be among those included in the case studies listed below:

  • Modulation, interferometry
  • T methods, including apodization, digital filtering
  • Autocorrelation
  • Phase-sensitive detection
  • Pump-probe experiments
  • Hyphenated techniques (special issues for interfacing separation/spectroscopy)
III. Spectroscopic Techniques and Applications
  • Readings assigned in class
  • Atomic absorption: an illustration of concepts
  • UV-Vis absorption (including so-called non-Beer's law issues)
  • IR absorption, including dichroism, sampling interferometry, Fourier Transforms
  • Emission techniques (AE, ICP, fluorescence, phosphorescence, IR)
  • Raman and resonance Raman scattering

Key to Readings:

IC:

  • J.D. Ingle, Jr. and S. R. Crouch, Spectrochemical Analysis (Prentice Hall: NY, 1988) (required text) D.C. Harris & M.D. Bertolucci, Symmetry & Spectroscopy (Dover Publications, NY 1989) (required text).

S:

  • H. A. Strobel and W. R. Heineman, Chemical Instrumentation (3rd ed. Wiley: NY, 1989).

M:

  • A. G. Marshall, Biophysical Chemistry (Wiley: NY, 1978). Copies of the appropriate chapters will be placed in folders on reserve in the Chem Library.

 

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Lecture Calendar :

Tuesday Date

Thursday Date

Aug 26 (1st Class)

Aug 28th

Sep 2

Sep 4

Sep 9

Sep 11

Sep 16

Sep 18

Sep 23

Sep 25

Sep 30 (Exam)

 

Oct 2 (No Class)

 

Oct 7

Oct 9 (No Class)

Oct 14 (No Class)

Oct 16

Oct 21

Oct 23

Oct 28 (Exam)

 

Oct 30 (No Class)

 

Nov 4

Nov 6

Nov 11

Nov 13 (No Class)

 

Nov 18

Nov 20

Nov 25

Nov 27 (Thanksgiving - No Class)

 

Dec 2

Dec 4

Dec 9

Dec 11 (Final Exam )

 

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Problem Sets :