Analytical Chemistry Lab Reports: Format and Calculations
Analytical Chemistry Lab Reports: Format and Calculations
Chemistry Lab Reports
Format and Calculations
John Collins
[email protected]
Measurement
• Analytical chemistry is entirely about
measurement, what these measurements signify,
and the understanding concerning the quality of
these measurements.
• In this class, you will be performing a number of
experiments to measure the concentrations of
various analytes and performing statistical
analysis on your data.
Quality of Measurements
• In each experiment, you will obtain sets of data.
• This data will be statistically analyzed to measure
the quality of the data.
• Accuracy and Precision are the two broad modes
utilized in determining the quality of your
measurements.
• Statistical Analysis allows you to mathematically
determine a higher relative degree of accuracy
and precision contained within your data.
Accuracy and Precision
• Accuracy is how close the mean (average) of all your data points is to the
actual (known) value. Reflects the degree of systematic error in your
experiment.
• Precision is a measure of the variability of all the data points—the degree
of consistency in reproducing the same data points. Reflects the degree of
random error in your experiment.
http://practicalanalyst.com/2007/12/18/good‐requirements‐are‐more‐than‐just‐accurate/
Statistical Analysis
• It should become intuitive when to use what
types of statistical analysis as the semester
continues.
• Understanding the concepts behind what each
applied statistic model reveals is the key to
good statistical analysis—and for that matter,
this is one fundamental key to sound scientific
ability.
Report Format
• Title of Report
‐Author(s)
‐Section
• Abstract
• Introduction
• Experimental
• Results
• Discussion
• Reference
• Appendix
Abstract
• What has been performed in the lab.
• Summary of results and conclusions.
• Report what you did and what you observed.
• Brief, brief, brief!!!!!
• 2 sentences. 3 maximum!!!!!!!!!!!
Good Abstract
“A single solution of unknown Cl‐ from NaCl in water was aliquoted and titrated
with AgNO3 through Fajans method. It can be said with 95% confidence that the
true mean of the percent weight of Cl‐ from the titrated samples was 59.6309 % ±
0.2479 %.”
• Very specific.
• What was done. What was discovered.
• Very brief. 2 sentences.
Bad Abstract
“The main objective of this lab was to determine an unknown chloride ion
concentration by the process of titration with a known concentration of silver
nitrate solution. The lab performed the standardization using Fajans method with
adsorption indicator that was dichlorofluorescenin as indicator. “
• Never start an abstract by describing the “objective” of the experiment.
• Say what you did, and what you found.
• This does not specify what was observed or discovered.
• The indicator is a detail which belongs in the experimental section.
Introduction
• Address the experiment and/or the problem
being investigated.
• Address the significance of the task at hand.
• Discuss the concepts/theory involved in the
experiment.
• If you choose to discuss the history of the
chemistry, or applications, this is where you
do it.
Good Introduction
“A Beer’s Law Plot and a standard addition plot are analyzed in this experiment. These two methods are
used to determine the concentration of an unknown Fe 3+ solution. The latter plot unlike the former one
considers the matrix effect—whereby the wavelengths of light emitted from other ions besides the
standard , interfere with the absorption of light from the Fe 3+ standard (or another ion of interest). We
must therefore account for the matrix effect if the two concentrations of the unknown are statistically
different. We can determine whether there is statistical difference between the two results using both the
t‐test and the f‐test. According to Beer’s Law, the absorption of the species of interest is directly
proportional to the concentration of the species. The species of interest for this experiment are both the
standard Fe 3+ and the unknown Fe 3+ . Beer’s Law accounts only for monochromatic radiation, so care
must be taken so that the solutions used for each plot are dilute.”
• The objective of the lab is pointed out , the theory behind the experiment and why it works is clearly,
succinctly explained.
Bad Introduction
“Spectrophotometry is used to determine the concentration of a solution of Fe3+. An iron‐containing tablet
is crushed and mixed with concentrated HCl. Water is added, and then filter paper is used to transfer the
iron solution to a 500ml volumetric flask and diluted with distilled water. Fe3+ is very weakly colored. 2,2'‐
dipyridine is added to the solution and forms an intensely colored complex with Fe3+. Standards of varying
concentration are prepared and the absorbances measured. “
• The far majority of this Intro belongs in the experimental section. Do not list your procedure in the
introduction.
• This intro doesn’t include the theory of Beers law nor how it is used or what it can tell us—which is the
main concept/theory behind the experiment.
Good Experimental Sample
“6.05 mL of 50% NaOH solution was added to the shoulder level of a 1‐L bottle using
a 10‐mL graduated cylinder. The solution was mixed inside the closed container.
25.00‐mL of white vinegar was dispensed into a 250‐mL volumetric flask using a
pipette, and distilled water was added to the mark. 25.00‐mL aliquots were
dispensed to each of the five 250‐mL Erlenmeyer flasks using a volumetric pipette.
50.04‐mL of distilled water and 3 drops of phenolphthalein indicator were added to
each flask.…..
• Experimental parameters were recorded according to what you, the experimenter,
did.
• You must record what you specifically did, especially the deviations from the
experiment instructions (e.g. The actual volumes and weights you took).
Bad Experimental Sample
“The experiment was started by preparing our NaOH solution with 6 mL of 50% NaOH solution
and diluting to the mark. It was used throughout the experiment to fill the burette for titration.
Five Erlenmeyer flasks filled with diluted vinegar and five flasks with weighed portions of KHP
were titrated with the NaOH solution. “
• This experiment section does not display the actual volumes and amounts that you used in the
experiment.
• This looks like the student just simply copied the lab procedure. Do Not do this!
• The experimental section displays precisely what YOU did, not what the procedure tells you to
do.
Good Results Bad Results
Section Section
• Include finalized and tabulated • DO NOT COPY AND PASTE THE
results that are not already in the SAME INFORMATION FROM YOUR
excel spreadsheet. EXCEL SPREADSHEET INTO YOUR
• Cite the excel file for all other data. FORMAL WRITTEN REPORT!
• Include finalized graphs/charts • Do not forget to cite all other
(with proper formatting, titles, data/results that have been
labels, etc.) your formal report.
accrued in your excel file.
• Make sure graphs are large
enough so we can clearly see the • DO NOT LIST AND ANSWER THE
relationship between the data QUESTIONS ASKED IN THE
points! EXPERIMENT. SEE DISCUSSION
• Include any detailed data SECTION FOR THIS.
calculation, error analysis, etc. that • If we gave you a template sheet or
you did not already perform/show template area for data or graphs in
in the excel file. the excel file, USE IT! Otherwise,
• Perform long calculations in the create it yourself in excel or import
appendix , yet cite them in the the properly formatted
results section.
data/graphs into your formal
report results section.
Inadequate Graph
90.00
80.00
70.00
60.00
50.00
40.00
30.00
20.00
10.00
0.00
0.00 10.00 20.00 30.00 40.00 50.00 60.00 70.00 80.00 90.00
• This graph has no title, no axis labels, no units, the numbers are so small I can’t read them, no
descriptive factors.
• Always use data points instead of lines. Only use lines when fitting a regression line to your data.
• I have no idea what I am looking at.
• This graph would not get a good score.
Adequate Graph
pH curve of NaOH‐Histidine Titration
11.75
9.75
7.75
pH
5.75
3.75
1.75
0 10 20 30 40 50 60 70 80
Volume of NaOH (mL)
• Graph is clearly labeled with a scale that allows me to identify the continuity of the data
points as well as individual x/y points.
• No outliers on the graphs.
• The main data points go through the center of the graph.
Good Results Sample
•This person listed only data which was not tabulated already in excel.
•This person also cited where you can find the appropriately formatted
and organized data/calculations.
•The template already provides you with the space and proper format.
‐There is no need to duplicate your data .
•Remember to always put units with ALL of your raw and calculated data
in BOTH your formal report and the corresponding excel template.
Discussion/Conclusion
• This is where you get to interpret/discuss your
calculated results, and what they mean.
• Do not list / answer the questions in # format!!!
• The excel templates have sections for each of the
questions asked in the experiment. You are
supposed to solve/calculate/answer the
questions in the template—that is what its for.
– But!!!!! The calculations/answers to the questions
asked in each experiment are key points of your
experiment. You should discuss the implications to
these questions with regard to your own data and
experiment in the discussion section, in report format.
Bad Discussion Sample
“Discussion
1. Shows on Excel data sheet1.
2. Shows on Excel data sheet1.
3. For the white vinegar, % acetic acid = 4.551%; for the red vinegar,
% acetic acid = 4.918%.
4. Shows on Excel data sheet1.
5. Done by Excel.
6. From the data, I conclude that the percentage of acetic acid in
the different brands (white and
red) of vinegar is statistically different to the 95 % CL, while %
white vinegar = 4.551%;
% red vinegar = 4.918%.”
• No # format!
• Discuss the implications of your data in light of the questions
asked—in paragraph format!
• Discuss areas of possible improvement or different types of error
which may have occurred during the experiment.
Good Discussion Sample
“……This result suggests that my concentration of NaCl,
which is 0.00678 M, is very reliable. For three titrations,
the solution was very faint in pink, which suggests that
almost an exact quantity of titrant was added to the
analyte for titration. The difference in the amount of both
reagents may be a few drops at the utmost. Whereas, my
partner’s true mean is 39.91± 7.57 for 95% confidence,
which means his true mean falls within a much larger range
from 32.34 mL to 47.54 mL for the same confidence
interval. Therefore, his data is much less precise than my
data. The standard deviation for my data set is 0.188
mL……..”
• Interpreting and discussion of the implications of your data
analysis is the primary point to all of these experiments!
References/Appendix
• Cite any references used—Your analytical
chem book, UMB handouts, Wikipedia, etc. in
the references section.
• Use your appendix to type in long calculations
and error analysis which you did not or could
not perform in excel. Remember to cite these
in your results section.
Excel Instructions
• Use the templates that we give you!!! These make
formatting and the timeliness of your reports much to your
advantage.
• You should be a master of excel when you are finished with
this class. Learn how to use excel! It will help your science
career indefinitely!!!
• DO NOT SIMPLY PUT ANSWERS IN THE APPROPRIATE CELLS.
I NEED TO SEE THE APPROPRIATE FORMULA TYPED IN THE
CELL OR REFERENCED TO THE APPROPRIATE CALCULATION
IN YOUR RESULTS SECTION!!
• YOU WILL RECEIVE NO CREDIT FOR ANSWERS WITHOUT
THE APPROPRIATE CALCULATIONS.
Excel Instructions
• This is where the majority of your work and your results will be located.
• Resources:
1. Step by step excel instructions and basic statistic function explanations:
http://alpha.chem.umb.edu/chemistry/ch313/Introduction%20to%20Measureme
nt.pdf
2. Text: Quantitative Chemical Analysis, 7th Edition by Harris
3. Optional: Applications of Microsoft Excel in Analytical Chemistry, by Crouch and
Holler.
4. Your peers
5. Me
6. More on Lab Report Format:
http://alpha.chem.umb.edu/chemistry/ch313/Report.pdf
7. Instructions for 2007 Excel version two variable input:
http://cameron.econ.ucdavis.edu/excel/ex53bivariateregressionstatisticalinference
.html
• Excel/Calculation examples……
Statistical Tests
Accuracy Precision
Mean Standard Deviation
(Average) (Measures variability
relative to mean)
Confidence Interval F‐Test
(True value lies within (Compares Precision
a given range based on of two data sets)
SD.)