The concepts taught in an undergraduate physical chemistry course are directly related to the molecular processes governing climate change, yet the connections between quantum mechanical molecular properties and global warming are rarely made explicit. To improve student knowledge about climate change, we developed a three-part activity that…

The point particle is an idealized object where rotational and vibrational motion is ignored. Nevertheless, in many cases such degrees of freedom play a significant role. For example, the rotation and vibration of a molecule is an important "reservoir" of its internal energy. The excitation of these types of motion can occur during the…

Recent progress in elucidating chemical reactions allows to explain chemistry by the potential energy of the involved chemical structures. Nevertheless, from an educational point of view, empirical results indicate that students often do not connect the core idea of energy with other chemical concepts. From a resource-oriented perspective,…

Molecules and Computer: Chemistry Calculations in Class (MC[superscript 4]) is a computational laboratory intended for final-year high school or undergraduate students. The topic is the antioxidant potential of anthocyanidins, which is chemically related to their radical scavenging action via the mechanism of hydrogen atom transfer (HAT). This…

In multielectron atoms or molecules, quantized electronic energy states known as term states provide a framework for interpreting absorption and emission spectra. Enumerating the term states associated with any particular electron configuration is possible using time-honored procedures, but the underpinnings of the methods do not always receive…

The contemporary Human activity utilizes huge volumes of digital data to solve efficiently multiple socio-economic, scientific and technical problems. Now the big data analysis is mainly oriented to the socioeconomic sphere with a goal to lift the profit. The science and technology to penetrate deeper in the nature of objects and systems under…

This is a fundamental and pedagogical work in quantum physics/chemistry, where we try to illustrate the Mulliken's question, "What are the electrons really doing in molecules?". And we also briefly review the development of the most popular numerical approaches in computational chemistry. We examine in a novel approach, how we can…

Nitrogen gas dominates the Earth's atmosphere but is largely ignored. Molecular nitrogen is extremely stable and so nitrogen is termed inert. What would happen if another 'inert' gas were the dominant species instead of molecular nitrogen? Here we show how unique nitrogen is and how important it has been to life on planet Earth.

Electromagnetic radiation can be classified into two major types depending on its ability to detach electrons from atoms: ionising and non-ionising. The aforementioned categorization is significant due to the effects of ionising radiation on human tissue (e.g. carcinogenesis). However, many students around the globe cannot distinguish these two…

One of the goals of science education is to help students make sense of the world around them. To that end, it is critical that students understand the central ideas in each discipline like, in chemistry, energy and interactions. These ideas are of particular importance because they are directly related to one another and are relevant across other…

Torsional effects influence kinetic selectivity in a wide range of organic transformations. As such, textbooks commonly use Newman projections to illustrate the torsional effects that arise in their transition states. Unfortunately, these representations fall short when the reaction occurs "within a ring." In many cases, the torsional…

An application for visualizing the dynamic properties of an equimolar binary mixture of isotropic reactive particles is presented. By introducing a user selectable choice for the activation energy, the application is useful to demonstrate qualitatively that the reaction rate depends on the above choice and on temperature. The application is based…

The VSEPR model has well-established limitations in its ability to represent accurate molecular and electronic geometries of simple molecules, which can create a significant need for students to relearn structure and bonding concepts in organic chemistry. We present an alternate method for describing molecular geometries and electronic structures…

A new undergraduate inorganic chemistry laboratory experiment is presented. An introduction of the spectrochemical series and ligand exchange is explored using the coordination complex dirhodium tetraacetate, Rh[subscript 2](OAc)[subscript 4]. Students have measured the absorption spectra of the Rh[subscript 2] complex in the presence of various…

Models that are used to predict and explain phenomena related to molecular vibration and rotation are ubiquitous in physical chemistry, and are of importance in many related fields. Yet, little work has been done to characterize student use and application of these models. We describe the results of a multi-year, multi-institutional qualitative…