Publications intéressantes

Foregrounding the Code: Computational Chemistry Instructional Activities Using a Highly Readable Fluid Simulation Code

An Alternative Experimental Procedure to Determine the Solubility of Potassium Nitrate in Water with Automatic Data Acquisition Using Arduino for Secondary School: Development and Validation with Pre-Service Chemistry Teachers

A Computational Experiment Introducing Undergraduates to Geometry Optimizations, Vibrational Frequencies, and Potential Energy Surfaces

Interactive Python Notebooks for Physical Chemistry

Applying Density Functional Theory to Common Organic Mechanisms: A Computational Exercise Jonathan P. Antle, Masashi W. Kimura, Stefano Racioppi, Corey Damon, Meredith Lang, Caitlyn Gatley-Montross, Laura S. Sánchez B., Daniel P. Miller, Eva Zurek, Adam M. Brown, Kellie Gast, and Scott M. Simpson, J. Chem. Educ. 2022, XXXX, XXX, XXX-XXX Publication Date:November 30, 2022 DOI: 10.1021/acs.jchemed.2c00935

Total Chemical Footprint of an Experiment: A Systems Thinking Approach to Teaching Rovibrational Spectroscopy Paul D. Cooper, Jacob Walser, J. Chem. Educ. 2019, 96(12), 2947-2951 DOI: 10.1021/acs.jchemed.9b00405

Valorization of Waste Orange Peel to Produce Shear-Thinning Gels Lucy S. Mackenzie, Helen Tyrrell, Robert Thomas, Avtar S. Matharu, James H. Clark, Glenn A. Hurst, J. Chem. Educ. 2019, 96(12), 3025-3029 DOI: 10.1021/acs.jchemed.8b01009

Helping Students Connect Interdisciplinary Concepts and Skills in Physical Chemistry and Introductory Computing: Solving Schrödinger’s Equation for the Hydrogen Atom Oka Kurniawan, Li Ling Apple Koh, Jermaine Zhi Min Cheng, Maggie Pee, J. Chem. Educ. 2019, 96(10), 2202-2207 DOI: 10.1021/acs.jchemed.9b00068

Teaching Entropy from Phase Space Perspective: Connecting the Statistical and Thermodynamic Views Using a Simple One-Dimensional Model Dhritiman Bhattacharyya, Jahan M. Dawlaty, J. Chem. Educ. 2019, 96(10), 2208-2216 DOI: 10.1021/acs.jchemed.9b00134

Demystifying Mathematical Modeling of Electrochemical Systems Lisa I. Stephens, Janine Mauzeroll, J. Chem. Educ. 2019, 96(10), 2217-2224 DOI: 10.1021/acs.jchemed.9b00542

Development of the Enthalpy and Entropy in Dissolution and Precipitation Inventory Timothy N. Abell, Stacey Lowery Bretz, J. Chem. Educ.2019, 96(9), 1804-1812, DOI: 10.1021/acs.jchemed.9b00186

Investigating Student Understanding of London Dispersion Forces: A Longitudinal Study Keenan Noyes, Melanie M. Cooper, J. Chem. Educ. 2019, 96(9), 1821-1832 DOI: 10.1021/acs.jchemed.9b00455

Bouncing Droplets: A Hands-On Activity To Demonstrate the Properties and Applications of Superhydrophobic Surface Coatings Carolina Cionti, Tommaso Taroni, Daniela Meroni, J. Chem. Educ. 2019, 96(9), 1971-1976 DOI: 10.1021/acs.jchemed.9b00406

Chemical Curiosity on Campus: An Undergraduate Project on the Structure and Wettability of Natural Surfaces Anthony Katselas, Alice Motion, Chiara O’Reilly, Chiara Neto, J. Chem. Educ. 2019, 96(9), 1998-2002 DOI: 10.1021/acs.jchemed.9b00324

Alternative Derivation of the Maxwell Distribution of Speeds Francisco Rivadulla, J. Chem. Educ. 2019, 96(9), 2063-2065 DOI: 10.1021/acs.jchemed.9b00188

Realistic Implementation of the Particle Model for the Visualization of Nanoparticle Precipitation and Growth Antonella Di Vincenzo, Michele A. Floriano, J. Chem. Educ. 2019, 96(8), 1654-1662 DOI: 10.1021/acs.jchemed.9b00330

Implementing New Educational Platforms in the Classroom: An Interactive Approach to the Particle in a Box Problem Vinícius Wilian D. Cruzeiro, Xiang Gao, Valeria D. Kleiman, J. Chem. Educ. 2019, 96(8), 1663-1670 DOI: 10.1021/acs.jchemed.9b00195

Development of the Quantization and Probability Representations Inventory as a Measure of Students’ Understandings of Particulate and Symbolic Representations of Electron Structure Zahilyn D. Roche Allred, Stacey Lowery Bretz, J. Chem. Educ. 2019, 96(8), 1558-1570 DOI: 10.1021/acs.jchemed.9b00098

Developing and Using a Computer Simulation of Liquid–Vapor Transitions to Improve Students’ Assimilation of Concepts Related to the Behavior of Real Gases David Zorrilla, Jesús Sánchez-Márquez, Víctor García, Manuel Fernández, J. Chem. Educ. 2019, 96(8), 1646-1653 DOI: 10.1021/acs.jchemed.8b00939

Enthalpy and the Second Law of Thermodynamics David Keifer, J. Chem. Educ., 2019, 96 (7), pp 1407-1411 DOI: 10.1021/acs.jchemed.9b00326

μdroPi: A Hand-Held Microfluidic Droplet Imager and Analyzer Built on Raspberry Pi Meng Sun, Zhengda LiQiong Yang, J. Chem. Educ., 2019, 96 (6), pp 1152-1156 DOI: 10.1021/acs.jchemed.8b00975

PChem Challenge Game: Reinforcing Learning in Physical Chemistry Tugba G. Kucukkal, Ajda Kahveci, J. Chem. Educ., 2019, 96 (6), pp 1187-1193 DOI: 10.1021/acs.jchemed.8b00757

Effect of Chemical and Physical Modifications on the Wettability of Polydimethylsiloxane Surfaces Carolyn L. Wanamaker, Brittany S. Neff, Azieta Nejati-Namin, Erin R. Spatenka, Mong-Lin Yang, J. Chem. Educ., 2019, 96 (6), pp 1212-1217 DOI: 10.1021/acs.jchemed.8b00814

Disseminating a Free, Practical Java Tool To Interactively Generate and Edit 2D Chemical Structures Andreas Hofmann, Mark J. Coster, Paul Taylor, J. Chem. Educ., 2019, 96 (6), pp 1262-1267 DOI: 10.1021/acs.jchemed.9b00073

Design, Fabrication, and Optical Characterization of a Low-Cost and Open-Source Spin Coater Mohammad Sadegh-cheri, J. Chem. Educ., 2019, 96 (6), pp 1268-1272 DOI: 10.1021/acs.jchemed.9b00013

Collaborative Learning Exercises for Teaching Protein Mass Spectrometry Michelle L. Kovarik, Jill K. Robinson, J. Chem. Educ. 2019, 96 (5) pp905-911 DOI: 10.1021/acs.jchemed.8b00734 + Biological Mass Spectrometry: Proteomics

A Tale of Two Molecules: How the Heat Capacities of N2(g) and F2(g) Differ At High Temperature and Why Naïve Expectations Fail to Explain These Differences: A Spreadsheet Exercise for Physical Chemistry Students Arthur M. Halpern and Robert J. Noll, J. Chem. Educ., 2019, 96 (5), pp 926–935 DOI: 10.1021/acs.jchemed.9b00029

Creating and Experimenting with a Low-Cost, Rugged System to Visually Demonstrate the Vapor Pressure of Liquids as a Function of Temperature Rodrigo Papai, Mayara Araujo Romano, Aline Rodrigues Arroyo, Bárbara Rodrigues da Silva, Bruno Tresoldi, Gabriela Cabo Winter, Julia Messias Costa, Maria Aparecida Freitas Santos, Matheus Damasceno Prata, and Ivanise Gaubeur, J. Chem. Educ., 2019, 96 (2), pp 335–341 DOI: 10.1021/acs.jchemed.8b00381

Teaching Boyle’s Law and Charles’ Law through Experiments that Use Novel, Inexpensive Equipment Yielding Accurate Results Taweetham Limpanuparb, Siradanai Kanithasevi, Maytouch Lojanarungsiri, and Puh Pakwilaikiat, J. Chem. Educ., 2019, 96 (1), pp 169–174 DOI: 10.1021/acs.jchemed.8b00460

Simple and Low-Cost Setup for Measurement of the Density of a Liquid Nima Noei, Iman Mohammadi Imani, Lee D. Wilson, and Saeid Azizian, J. Chem. Educ., 2019, 96 (1), pp 175–179 DOI: 10.1021/acs.jchemed.7b00979

Reduction of Water Waste in an Organic Chemistry Laboratory Using a Low-Cost Recirculation System for Condenser Apparatus Alex Schoeddert, Keshwaree Babooram, and Sarah Pelletier J. Chem. Educ., 2019, 96 (1), pp 180–182 DOI: 10.1021/acs.jchemed.8b00400

Graphical Representation of Hydrogenic Orbitals: Incorporating Both Radial and Angular Parts of the Wave Function Meghna A. Manae and Anirban Hazra, J. Chem. Educ., 2019, 96 (1), pp 187–190 DOI: 10.1021/acs.jchemed.8b00372

Wetting Modification by Photocatalysis: A Hands-on Activity To Demonstrate Photoactivated Reactions at Semiconductor Surfaces Luca Rimoldi, Tommaso Taroni, and Daniela Meroni, J. Chem. Educ., 2018, 95 (12), pp 2216–2221 DOI: 10.1021/acs.jchemed.8b00362

Constructing the Phase Diagram of a Single-Component System Using Fundamental Principles of Thermodynamics and Statistical Mechanics: A Spreadsheet-Based Learning Experience for Students Arthur M. Halpern and Charles J. Marzzacco, J. Chem. Educ., 2018, 95 (12), pp 2197–2204 DOI: 10.1021/acs.jchemed.8b00560

Using the Principles of Classical and Statistical Thermodynamics To Calculate the Melting and Boiling Points, Enthalpies and Entropies of Fusion and Vaporization of Water, and the Freezing Point Depression and Boiling Point Elevation of Ideal and Nonideal Aqueous Solutions Arthur M. Halpern and Charles J. Marzzacco, J. Chem. Educ., 2018, 95 (12), pp 2205–2211 DOI: 10.1021/acs.jchemed.8b00561

The Gibbs Phase Rule: What Happens When Some Phases Lack Some Components? Deepika Janakiraman, J. Chem. Educ., 2018, 95 (11), pp 2086–2088 DOI: 10.1021/acs.jchemed.8b00377

Liquid Crystal Demonstration of Binary Phase Behavior for the Classroom Marissa E. Tousley, J. Chem. Educ., 2018, 95 (11), pp 2000–2005 DOI: 10.1021/acs.jchemed.8b00081

Approximate Equation To Calculate Partial Pressures in a Mixture of Real Gases Bernard Hayez, J. Chem. Educ., 2018, 95 (11), pp 1982–1988 DOI: 10.1021/acs.jchemed.8b00185

Investigation of the Ternary Phase Diagram of Water–Propan-2-ol–Sodium Chloride: A Laboratory Experiment Cory C. Pye, M. Angelique Imperial, Coltin Elson, Megan L. Himmelman, Jacquelyn A. White, and Fuhao Lin, J. Chem. Educ., 2018, 95 (8), pp 1398–1401 DOI: 10.1021/acs.jchemed.8b00242

Pedagogical Approach to the Modeling and Simulation of Oscillating Chemical Systems with Modern Software: The Brusselator Model Jaime H. Lozano-Parada, Helen Burnham, and Fiderman Machuca Martinez, J. Chem. Educ., 2018, 95 (5), pp 758–766 DOI: 10.1021/acs.jchemed.7b00703

Facilitating Students’ Interaction with Real Gas Properties Using a Discovery-Based Approach and Molecular Dynamics Simulations Chelsea Sweet, Oyewumi Akinfenwa, and Jonathan J. Foley, IV J. Chem. Educ., 2018, 95 (3), pp 384–392 DOI: 10.1021/acs.jchemed.7b00747

Radius Ratio Rule Rescue Anna Michmerhuizen, Karine Rose, Wentiirim Annankra, and Douglas A. Vander Griend, J. Chem. Educ., 2017, 94 (10), pp 1480–1485 DOI: 10.1021/acs.jchemed.6b00970

Development and Use of an Open-Source, User-Friendly Package To Simulate Voltammetry Experiments Shuo Wang, Jing Wang, and Yanjing Gao, J. Chem. Educ., 2017, 94 (10), pp 1567–1570 DOI: 10.1021/acs.jchemed.6b00986

Adapting and Modifying the Apparatus for Students To Accurately Determine the Freezing Point of a Solvent and Solution Shirong Li, Jianzhong Guo, Kewang Wang, Lin Chen, Daodao Hu, and Yunshan Bai, J. Chem. Educ., 2017, 94 (10), pp 1590–1593 DOI: 10.1021/acs.jchemed.7b00253

Periodic Reactions: The Early Works of William C. Bray and Alfred J. Lotka Rinaldo Cervellati and Emanuela Greco, J. Chem. Educ., 2017, 94 (2), pp 195–201 DOI: 10.1021/acs.jchemed.6b00342

Partially Miscible Water–Triethylamine Solutions and Their Temperature Dependence, Johan P. Erikson, J. Chem. Educ., 2017, 94 (1), pp 75–78 DOI: 10.1021/acs.jchemed.6b00489

Improving Students’ Understanding of the Connections between the Concepts of Real-Gas Mixtures, Gas Ideal-Solutions, and Perfect-Gas Mixtures, Romain Privat, Jean-Noël Jaubert, and Edouard Moine, J. Chem. Educ., 2016, 93 (12), pp 2040–2045 DOI: 10.1021/acs.jchemed.6b00553

Let Students Derive, by Themselves, Two-Dimensional Atomic and Molecular Quantum Chemistry from Scratch, Yingbin Ge, J. Chem. Educ., 2016, 93 (12), pp 2033–2039 DOI: 10.1021/acs.jchemed.6b00572

Assembling and Using a Simple, Low-Cost, Vacuum Filtration Apparatus That Operates without Electricity or Running Water Fengxiu Zhang, Yiwei Hu, Yaling Jia, Yonghua Lu, and Guangxian Zhang, J. Chem. Educ., 2016, 93 (10), pp 1818–1820 DOI: 10.1021/acs.jchemed.5b00997

Rethinking Undergraduate Physical Chemistry Curricula, Stephen R. Miller, J. Chem. Educ., 2016, 93 (9), pp 1536–1542 DOI: 10.1021/acs.jchemed.5b00945

Teaching the Concept of Gibbs Energy Minimization through Its Application to Phase-Equilibrium Calculation, Romain Privat, Jean-Noël Jaubert, Etienne Berger, Lucie Coniglio, Cécile Lemaitre, Dimitrios Meimaroglou, and Valérie Warth, J. Chem. Educ., 2016, 93 (9), pp 1569–1577 DOI: 10.1021/acs.jchemed.6b00205

Interactively Applying the Variational Method to the Dihydrogen Molecule: Exploring Bonding and Antibonding, Vinícius Wilian D. Cruzeiro, Adrian Roitberg, and Nicolas C. Polfer, J. Chem. Educ., 2016, 93 (9), pp 1578–1585 DOI: 10.1021/acs.jchemed.6b00017

Determination of Surface Tension of Surfactant Solutions through Capillary Rise Measurements: An Image-Processing Undergraduate Laboratory Experiment, Cristián Huck-Iriart, Ariel De-Candia, Javier Rodriguez, and Carlos Rinaldi, J. Chem. Educ., 2016, 93 (9), pp 1647–1651 DOI: 10.1021/acs.jchemed.6b00128

An Alternative Presentation of the Second Law of Thermodynamics Sangyoub Lee, Kyusup Lee, and Jiyon Lee, J. Chem. Educ., 2015, 92 (4), pp 771–773 DOI: 10.1021/ed5007822

Measuring the Speed of Sound through Gases Using Nitrocellulose Karen Sinclair Molek, Karl A. Reyes, Brandon A. Burnette, and Jacob R. Stepherson, J. Chem. Educ., 2015, 92 (4), pp 762–766 DOI: 10.1021/ed400653t

Cost Effective Paper-Based Colorimetric Microfluidic Devices and Mobile Phone Camera Readers for the Classroom Myra T. Koesdjojo, Sumate Pengpumkiat, Yuanyuan Wu, Anukul Boonloed, Daniel Huynh, Thomas P. Remcho, and Vincent T. Remcho, J. Chem. Educ., 2015, 92 (4), pp 737–741 DOI: 10.1021/ed500401d

Fabrication of a Paper-Based Microfluidic Device To Readily Determine Nitrite Ion Concentration by Simple Colorimetric Assay Bo Wang, Zhiqiang Lin, and Min Wang, J. Chem. Educ., 2015, 92 (4), pp 733–736 DOI: 10.1021/ed500644m

Hydrogen Storage Experiments for an Undergraduate Laboratory Course—Clean Energy: Hydrogen/Fuel Cells Alla Bailey, Lisa Andrews, Ameya Khot, Lea Rubin, Jun Young, Thomas D. Allston, and Gerald A. Takacs, J. Chem. Educ., 2015, 92 (4), pp 688–692 DOI: 10.1021/ed5006294

Are the Concepts of Dynamic Equilibrium and the Thermodynamic Criteria for Spontaneity, Nonspontaneity, and Equilibrium Compatible? Lee J. Silverberg, Lionel M. Raff, J. Chem. Educ., 2015, 92 (4), pp 655–659 DOI: 10.1021/ed500660j

Implementing an Inexpensive and Accurate Introductory Gas Density Activity with High School Students W. Patrick Cunningham, Christopher Joseph, Samantha Morey, Ana Santos Romo, Cullen Shope, Jonathan Strang, and Kevin Yang, J. Chem. Educ., 2015, 92 (9), pp 1507–1509 DOI: 10.1021/acs.jchemed.5b00277

What Is a Kilogram in the Revised International System of Units (SI)? Richard S. Davis, J. Chem. Educ., 2015, 92 (10), pp 1604–1609 DOI: 10.1021/acs.jchemed.5b00285

Deconstructing Phase Diagram Calculations Pierre Tomasini, J. Chem. Educ., 2014, 91 (6), pp 934–936 DOI: 10.1021/ed400364s

Binary Solid–Liquid Phase Diagram of Phenol and t-Butanol: An Undergraduate Physical Chemistry Experiment Xinhua Xu, Xiaogang Wang, and Meifen Wu, J. Chem. Educ., 2014, 91 (6), pp 929–933 DOI: 10.1021/ed400598s

An Integrated Visualization and Basic Molecular Modeling Laboratory for First-Year Undergraduate Medicinal Chemistry Joseph M. Hayes, J. Chem. Educ., 2014, 91 (6), pp 919–923 DOI: 10.1021/ed400486d

Using a Spreadsheet To Solve the Schrödinger Equations for the Energies of the Ground Electronic State and the Two Lowest Excited States of H2 Yingbin Ge, Robert C. Rittenhouse, Jacob C. Buchanan, and Benjamin Livingston, J. Chem. Educ., 2014, 91 (6), pp 853–859 DOI: 10.1021/ed400693p (? en Python ?)

Use of JANAF Tables in Equilibrium Calculations and Partition Function Calculations for an Undergraduate Physical Chemistry Course David A. Cleary, J. Chem. Educ., 2014, 91 (6), pp 848–852 DOI: 10.1021/ed400545x

Scent Transmutation: A New Way To Teach on Chemical Equilibrium, Distillation, and Dynamic Combinatorial Chemistry Qing Ji, Nadia S. El-Hamdi, and Ognjen Š. Miljanić, J. Chem. Educ., 2014, 91 (6), pp 830–833 DOI: 10.1021/ed400681w

University chemistry students’ interpretations of multiple representations of the helium atom Zahilyn D. Roche Allred and Stacey Lowery Bretz, Chem. Educ. Res. Pract., 2019,20, 358-368 DOI: 10.1039/C8RP00296G

Some remarks concerning the thermodynamics of the simple ideal gas and related mathematical background, Láng, G.G. ChemTexts (2016) 2: 10. doi:10.1007/s40828-016-0028-2