The development and application of a simulator designed with Excel spreadsheets to teach procedural skills in atomic absorption spectrometry and atomic emission spectrometry are proposed. For the development of the simulator, different analytical procedures were followed including analysis of pharmaceutical, forensic, and environmental samples.…

The Beer-Lambert law is a core spectroscopic relationship widely used across the undergraduate chemistry curriculum and beyond. The derivation of this model is a common topic for upper-level chemistry courses. But, due to its abstract nature, this derivation can often seem like a mathematical exercise detached from the molecular origins of…

Lecture-only chemistry courses without a dedicated laboratory component present a significant challenge for instructors to reinforce course content with hands-on learning experiences. This is especially true for lecture courses in which students are unable to directly visualize and operate instrumentation. Herein, we present an in-class activity…

Students used an Excel spreadsheet and a Jupyter notebook located at https://chemcompute.org/jupyterhub/ to generate data in lieu of face-to-face laboratory instruction during COVID-19. This communication discusses strengths and weaknesses of both exercises. First, students generated absorbance data using an Excel spreadsheet, but they were…

An activity supporting the PhET interactive simulation, Models of the Hydrogen Atom, has been designed and used in the laboratory portion of a general chemistry course. This article describes the framework used to successfully accomplish implementation on a large scale. The activity guides students through a comparison and analysis of the six…

This article describes the High-Adventure Science curriculum unit "Is There Life in Space?" This free online investigation, developed by The Concord Consortium, helps students see how scientists use modern tools to locate planets around distant stars and explore the probability of finding extraterrestrial life. This innovative curriculum…

A simple algorithm was implemented in a spreadsheet program to simulate the circular dichroism spectra of proteins from their secondary structure content and to fit [alpha]-helix, [beta]-sheet, and random coil contents from experimental far-UV circular dichroism spectra. The physical basis of the method is briefly reviewed within the context of…

In proteomics, complex mixtures of proteins are separated (usually by chromatography or electrophoresis) and identified by mass spectrometry. We have created 2DE Tandem MS, a computer program designed for use in the biochemistry, proteomics, or bioinformatics classroom. It contains two simulations--2D electrophoresis and tandem mass spectrometry.…

The near-UV spectrum of benzene is used to illustrate the effects of variations in instrument spectral bandwidth on absorbance and molar absorptivity measurements and on the independence of values of quantities such as the oscillator strength that are based on integrated absorptivity. Excel-based computer simulations are provided that help develop…

This dissertation has two primary concerns: (i) evaluating the uncertainty and prediction capabilities of a nanodiamond drug delivery model using Bayesian calibration and bias correction, and (ii) determining conceptual difficulties of multi-scale analysis from an engineering education perspective. A Bayesian uncertainty quantification scheme…

In this undergraduate physical chemistry laboratory experiment, students acquire a high-resolution infrared absorption spectrum of carbon dioxide and use their data to show that the rotational-vibrational state populations follow a Boltzmann distribution. Data are acquired with a mid-infrared laser source and infrared detector. Appropriate…

An approach that is useful to any introductory nuclear magnetic resonance (NMR) spectroscopy course is developed. This approach to teaching NMR spectrometry includes spectral simulation along with the traditional elements of hands-on instrument use and structure elucidation to demonstrate the connection between simulating a spectrum and structure…

A real-life analytical assignment is presented to students, who had to examine an air conditioning coolant solution for metal contamination using an atomic absorption spectroscopy (AAS). This hands-on access to a real problem exposed the undergraduate students to the mechanism of AAS, and promoted participation in a simulated industrial activity.