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Solubility of Lead Chloride: Common Ion and Complexation Effects in a Greener Laboratory Experiment 氯化铅的溶解性:绿色实验室实验中的常见离子和络合效应
IF 3 3区 教育学 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-06-27 DOI: 10.1021/acs.jchemed.4c00336
George Lisensky, Corbin Livingston
Lead chloride has a moderate solubility, allowing small, but quantifiable, amounts to be used in a lab experiment studying solubility. Two gravimetric methods are compared by each student. The first method involves weighing excess lead chloride before and after dissolution. The second method precipitates dissolved lead ion from a saturated solution. The most common error in both methods, not collecting all of the solid, results in high solubility values in the first method and low solubility values in the second. This can lead to rich student discussion and evaluation of these techniques. Using sulfate as the precipitating agent is greener than using chromate as the precipitating agent; similar results are obtained, and the importance of green chemistry can be introduced. To further enrich the chemistry content exploration in this lab experiment, each student measures solubility in a different sodium chloride concentration, leading to observable common ion and complexation effects. This laboratory experiment is done in one 3 h lab period in an analytical chemistry course that has a heavy emphasis on chemical equilibria and is followed up by additional calculations later in the course.
氯化铅的溶解度适中,可以在研究溶解度的实验室实验中使用少量但可定量的氯化铅。每个学生都要比较两种重量法。第一种方法是在溶解前后称量过量的氯化铅。第二种方法是从饱和溶液中析出溶解的铅离子。这两种方法中最常见的错误是没有收集全部固体,导致第一种方法中溶解度值偏高,而第二种方法中溶解度值偏低。这可以引导学生对这些技术进行丰富的讨论和评估。使用硫酸盐作为沉淀剂比使用铬酸盐作为沉淀剂更环保;得到的结果相似,可介绍绿色化学的重要性。为进一步丰富本实验中的化学探索内容,每个学生测量不同浓度氯化钠中的溶解度,从而观察常见离子和络合效应。本实验是在分析化学课程中一个 3 小时的实验时间内完成的,该课程主要强调化学平衡,并在课程后期进行了额外的计算。
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引用次数: 0
Multimodal Generative Artificial Intelligence Tackles Visual Problems in Chemistry 多模态生成人工智能解决化学中的视觉问题
IF 3 3区 教育学 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-06-26 DOI: 10.1021/acs.jchemed.4c00138
Eman A. Alasadi, Carlos R. Baiz
The introduction of multimodal capabilities in large language models (LLMs) marks a significant advancement in the field of artificial intelligence (AI). In particular, the ability to process and interpret visual data, including complex graphs and plots frequently encountered in chemistry, expands the potential of these models. This integration of text and image processing allows multimodal AI to tackle a broader range of problems, especially in areas where visual information is central to understanding and solving problems. This study provides an examination of GPT-4’s image input capabilities, specifically targeting its efficacy in interpreting and solving chemistry problems that require graphical information. This study evaluates GPT-4’s image input feature, focusing on its accuracy in interpreting chemical diagrams, structures, and tabular data, and its utility as an interactive, conversational tutor in chemistry education. The research assesses the consistency of the AI’s responses to visual data of varying quality and its ability to parse handwritten problems and answers. Further, the study examines GPT-4’s capacity for molecular structure analysis and spectral data interpretation, vital for advanced problem-solving in chemistry. Through analysis, we demonstrate how the image processing capabilities of GPT-4 could be leveraged for pedagogical purposes, particularly in undergraduate chemistry courses. In addition, we provide advice for prompt development to improve response quality.
在大型语言模型(LLM)中引入多模态功能标志着人工智能(AI)领域的重大进步。特别是处理和解释可视化数据(包括化学中经常遇到的复杂图形和绘图)的能力,拓展了这些模型的潜力。这种文本和图像处理的整合使得多模态人工智能能够解决更广泛的问题,尤其是在视觉信息对于理解和解决问题至关重要的领域。本研究考察了 GPT-4 的图像输入能力,特别是其在解释和解决需要图形信息的化学问题方面的功效。本研究对 GPT-4 的图像输入功能进行了评估,重点关注其在解释化学图表、结构和表格数据方面的准确性,以及其作为化学教育中交互式对话辅导的实用性。这项研究评估了人工智能对不同质量的视觉数据做出反应的一致性,以及解析手写问题和答案的能力。此外,本研究还考察了 GPT-4 的分子结构分析和光谱数据解读能力,这对解决化学高级问题至关重要。通过分析,我们展示了如何将 GPT-4 的图像处理能力用于教学目的,特别是本科生化学课程。此外,我们还提供了及时开发以提高响应质量的建议。
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引用次数: 0
Enhancing Undergraduate Student’s Interest in Solid State Chemistry by Characterizing Kidney Stones Using Powder X-ray Diffraction 通过粉末 X 射线衍射表征肾结石提高本科生对固体化学的兴趣
IF 3 3区 教育学 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-06-26 DOI: 10.1021/acs.jchemed.4c00294
Infal Iqbal, Nazra Nawaz, Sajida Noureen, Maqsood Ahmed
A laboratory experiment has been designed for undergraduate students with a major in biology to provide experience-based learning in solid-state chemistry and powder X-ray diffraction using human kidney stones. In this laboratory experiment, students will learn sample preparation, gain hands-on experience with a powder X-ray diffractometer, monitor the factors that affect a diffractogram, and do some basic calculations. In addition to practical experience, the introduction and use of a powder X-ray diffraction database were used for this experiment. Students will gain insight into the phase-matching process, which involves matching the diffractograms of kidney stones with those of known phases from the database. Overall, this laboratory experience will provide a fundamental understanding of powder X-ray diffraction with a practical example of kidney stones. Beginning with sample preparation and ending with phase determination, students will develop a keen interest in solid-state chemistry by using human pathological samples in real-world applications of powder X-ray diffraction.
我们为生物专业的本科生设计了一个实验室实验,利用人体肾结石为他们提供固态化学和粉末 X 射线衍射方面的体验式学习。在这个实验室实验中,学生将学习样品制备,获得粉末 X 射线衍射仪的实际操作经验,监测影响衍射图的因素,并进行一些基本计算。除实践经验外,本实验还使用了粉末 X 射线衍射数据库的介绍和使用。学生将深入了解相匹配过程,包括将肾结石的衍射图与数据库中已知相的衍射图进行匹配。总之,这次实验室体验将通过肾结石的实际例子,让学生对粉末 X 射线衍射有一个基本的了解。从样品制备开始到相测定结束,学生将通过在粉末 X 射线衍射的实际应用中使用人体病理样品,培养对固态化学的浓厚兴趣。
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引用次数: 0
Cobalt-Doped Aluminum Aerogels as Photocatalyst Fabricated by a Liquid Metal Reaction Method in the Laboratory 实验室用液态金属反应法制备的掺钴铝气凝胶光催化剂
IF 3 3区 教育学 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-06-24 DOI: 10.1021/acs.jchemed.4c00322
Qianhui Xu, Zixuan Lv, Yizhong Zhu, Danyang Li, Hang Zhang, Yang Yang, Dandan Cui, Guangchao Li, Weichang Hao, Yi Du
Pollution and its treatment have been major challenges for society over the past few decades. We designed a laboratory experiment for junior and senior undergraduates who major in physics, chemistry engineering, or material science, aiming to improve students’ interests in material exploration and photocatalyst development and characterization. In order to ensure that students can understand systematic learning, our entire experiment includes sample synthesis and characterization. We introduced the students to an experiment to develop a method to fabricate cobalt-doped aluminum hydroxide aerogels by using liquid metal as the precursor and sacrificial agent, which is extremely simple and environmentally green compared to conventional aerogel synthesis methods. The physical properties of the synthesized samples are studied by various characterization methods, including X-ray diffraction (XRD), scanning electron microscopy (SEM), and UV–visible light spectroscopy. The degradation results of our samples under different conditions illustrate the photocatalytic mechanism of cobalt-doped aluminum hydroxide aerogels and show that the photocatalytic efficiency can be significantly enhanced by a moderate doping ratio of cobalt. This interdisciplinary experiment provides students with design ideas for efficient photocatalytic materials and provides a new way to familiarize themselves with the general process of material synthesis, characterization, and photocatalytic degradation. It is also a good training for shaping students’ ability of literature reading, hands-on experiments, data collection, and their analyzing ability of fundamental mechanisms beneath the experimental phenomena.
过去几十年来,污染及其治理一直是社会面临的重大挑战。我们为物理、化学工程或材料科学专业的大三和大四本科生设计了一个实验,旨在提高学生对材料探索和光催化剂开发与表征的兴趣。为了确保学生能够理解系统性学习,我们的整个实验包括样品合成和表征。我们在实验中向学生介绍了一种以液态金属为前驱体和牺牲剂来制备掺钴氢氧化铝气凝胶的方法,与传统的气凝胶合成方法相比,这种方法极其简单,而且绿色环保。通过 X 射线衍射 (XRD)、扫描电子显微镜 (SEM) 和紫外可见光光谱等多种表征方法研究了合成样品的物理性质。样品在不同条件下的降解结果说明了掺钴氢氧化铝气凝胶的光催化机理,并表明适度的钴掺杂比例可显著提高光催化效率。这一跨学科实验为学生提供了高效光催化材料的设计思路,为他们熟悉材料合成、表征和光催化降解的一般过程提供了新的途径。同时,这也是对学生文献阅读能力、实验动手能力、数据收集能力以及对实验现象背后基本机理分析能力的良好训练。
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引用次数: 0
Introductory Medicinal Chemistry for Pharmacy Students: An Assignment-Based Online Assessment Strategy 药学专业学生的药物化学入门:基于作业的在线评估策略
IF 3 3区 教育学 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-06-22 DOI: 10.1021/acs.jchemed.3c01117
David L. Jakeman
New assessment approaches for medicinal chemistry in an introductory course within the pharmacy curriculum are presented. A required introductory pharmaceutical sciences course specific for first year entry-to-practice pharmacy (PharmD) students was developed concurrently within the mandated online learning environment of COVID19. Instead of in-person or online examinations for the medicinal chemistry section, students were required to complete online assignments over the semester. The first series of assignments involved interpretation of a series of specific drug-target PDB structures, using molecular viewing software, to devise new drug analogues, and to rationalize the structural modifications based on proposing specific molecular interactions with the target, with structures being submitted to an online portal as SMILES codes. The final assignment required students to create an online 3 min video describing a specific drug–target interaction, the mechanism of action, structure–activity and additional considerations (adsorption, distribution, metabolism, excretion, toxicity) relevant to the specific drug. In subsequent academic years, the same course was delivered in-person to the first year pharmacy students and quantitative feedback collected. Specific questions were posed in addition to those evaluating the instructor, to better understand the student perspective on the assignments. Initial qualitative feedback was highly supportive of the assignment-based assessment strategy. In subsequent years the student feedback was quantified, and the data indicated that the students preferred the assignments over multiple choice or short answer examination assessment.
介绍了药学课程入门课程中药物化学的新评估方法。在 COVID19 规定的在线学习环境中,同时开发了一门专为药剂学(PharmD)一年级入门学生开设的药学入门必修课程。在药物化学部分,学生不需要参加现场考试或在线考试,而是需要在一学期内完成在线作业。第一个系列的作业包括使用分子观察软件解读一系列特定药物-靶点 PDB 结构,设计新的药物类似物,并根据提出的与靶点的特定分子相互作用合理调整结构,将结构作为 SMILES 代码提交到在线门户网站。最后的作业要求学生制作一个 3 分钟的在线视频,描述特定药物与靶点的相互作用、作用机制、结构-活性以及与特定药物相关的其他考虑因素(吸附、分布、代谢、排泄、毒性)。在随后的学年中,药剂学专业的一年级学生将面对面学习相同的课程,并收集定量反馈。除了评价教师的问题外,还提出了具体问题,以更好地了解学生对作业的看法。最初的定性反馈非常支持基于作业的评估策略。随后几年,对学生的反馈进行了量化,数据显示,与选择题或简答题考试评估相比,学生更喜欢作业。
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引用次数: 0
From Controlled Reactions to the Thermal Runaway: Radical Polymerization as an Undergrad Lab Course Exercise for Enhanced Process Safety Awareness 从受控反应到热失控:将自由基聚合作为本科生实验室课程练习,提高过程安全意识
IF 3 3区 教育学 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-06-21 DOI: 10.1021/acs.jchemed.4c00072
Felix Leibetseder, Lukas Göpperl, Marco Orthofer, Roland Obermüller, Klaus Bretterbauer
Free radical polymerization is a common tool in industry to produce a vast array of different useful polymers. The convenient polymerization reaction known for decades is carried out industrially on a multiton scale and is also known to be very safety-critical. The self-accelerating nature of free radical polymerization demands control and careful reaction design to avoid thermal runaway. Herein, a student experiment for a practical lab course is presented, which uses free radical polymerization as a convenient model for a process safety-relevant reaction. The homopolymerization of butyl acrylate is conducted with different setups to show what happens if evaporative cooling is correctly applied, if cooling of the reaction fails, and if no evaporative cooling is applied at all. The experimental plan is versatile and can be conducted by the students themselves in a time frame of one lab day or as a shortened variation of 3–4 h. If necessary, the experiment can also be prepared in advance by a supervisor and shown to a classroom in approximately 1 h. The costs for the needed chemicals and solvents are very low, and the equipment needed can be varied from a standard preparative organic chemistry setup to online digital temperature recording and monitoring. The described polymerization of butyl acrylate is a model system to teach the concept of reaction heat and evaporative cooling, shows the usefulness of reaction calorimetry, and improves the awareness of process safety and critical thinking during the design of new experiments.
自由基聚合是工业中生产各种有用聚合物的常用工具。这种方便的聚合反应几十年来一直在工业上以多吨规模进行,而且众所周知,它对安全至关重要。自由基聚合反应的自加速特性要求对反应进行控制和精心设计,以避免热失控。本文介绍了一个用于实践实验课程的学生实验,该实验将自由基聚合作为与工艺安全相关的反应的便捷模型。丙烯酸丁酯的均聚反应采用了不同的设置,以显示在正确使用蒸发冷却、反应冷却失败以及完全不使用蒸发冷却的情况下会发生什么。所需的化学品和溶剂的成本非常低,所需的设备可以从标准的制备有机化学装置到在线数字温度记录和监控。所描述的丙烯酸丁酯聚合反应是一个示范系统,可用于教授反应热和蒸发冷却的概念,显示反应量热计的实用性,并在设计新实验时提高过程安全意识和批判性思维。
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引用次数: 0
From Spark to Fire─Preparation of Molecular-Based Piezoelectric Material, Fabrication of Devices, and Demonstration of Piezoelectric Effect: An Innovative Experiment for First-Year Undergraduates 从火花到火焰--分子压电材料的制备、器件的制作和压电效应的演示:一年级本科生的创新实验
IF 3 3区 教育学 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-06-21 DOI: 10.1021/acs.jchemed.4c00113
Zhirui Li, Tongxv Qi, Jiayao Liu, Pijun Su, Zhengxiao Tang, Haixia Zhao, Zhiqiang Dong, Yanping Ren, Lasheng Long, Lansun Zheng
For the first-year undergraduates, electronegativity, molecular polarity, dipole moment, etc. are all relatively abstract concepts and have been covered in inorganic chemistry or general chemistry courses. In fact, the piezoelectric effect is the macroscopic expression of electric dipole moments and molecular polarity in solids, which is the ability to convert mechanical stress into electricity or vice versa. Based on recent research findings in molecular-based piezoelectric materials, we designed a laboratory experiment including the synthesis of molecular-based piezoelectric material N(CH3)4GaCl4, the fabrication of piezoelectric devices, and the demonstration of piezoelectric effects by illuminating LEDs in order to help the first-year undergraduates to understand these concepts. This experiment enhances students’ comprehension of relatively abstract concepts such as molecular polarity, dipole moment, and the piezoelectric effect. And this experiment not only bridges the gap between cutting-edge research and basic chemistry laboratory teaching but also effectively integrates fundamental principles, methods, and experimental skills related to the inorganic compound preparation and separation, piezoelectric effect generation, and piezoelectric device fabrication. It is a multidisciplinary experiment that covers chemistry, materials science, physics, and energy-related themes, fosters students’ interest in hands-on experimentation, and cultivates their ability to apply theoretical knowledge in practical circumstances. The experiment was carried out successfully in 1 round by 350 first-year undergraduates majoring in chemistry, chemical engineering, and materials science and engineering at Xiamen University and was well received by students and teachers.
对于本科一年级的学生来说,电负性、分子极性、偶极矩等都是比较抽象的概念,在无机化学或普通化学课程中已经有所涉及。事实上,压电效应是电偶极矩和分子极性在固体中的宏观表现,是将机械应力转化为电能或反之亦然的能力。基于分子压电材料的最新研究成果,我们设计了一个实验,包括合成分子压电材料 N(CH3)4GaCl4、制作压电器件以及通过点亮 LED 演示压电效应,以帮助本科一年级学生理解这些概念。该实验增强了学生对分子极性、偶极矩和压电效应等相对抽象的概念的理解。本实验不仅在前沿研究和基础化学实验教学之间架起了一座桥梁,而且有效地整合了与无机化合物制备和分离、压电效应产生和压电器件制作相关的基本原理、方法和实验技能。该实验涉及化学、材料科学、物理学和能源相关主题,是一个多学科实验,培养了学生动手实验的兴趣,培养了学生在实际环境中应用理论知识的能力。该实验由厦门大学化学、化学工程、材料科学与工程等专业的 350 名一年级本科生参与,已成功进行了 1 轮,受到了师生们的一致好评。
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引用次数: 0
Calculating Thermodynamic Stabilities of Keto–Enol Tautomers of Aldehydes, Ketones, Esters, and Amides 计算醛、酮、酯和酰胺的酮烯醇同素异形体的热力学稳定性
IF 3 3区 教育学 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-06-20 DOI: 10.1021/acs.jchemed.4c00234
Nanette M. Wachter, Evan H. Kreth, Ronald P. D’Amelia
Keto–enol tautomerization is paramount to understanding the mechanisms involved in many organic reactions and biochemical transformations. Isomerization of an enol to a carbonyl compound is typically introduced during the discussion of the acid-catalyzed electrophilic addition of water to alkynes. The tautomerization of carbonyl compounds to enol isomers is discussed in much greater detail when the reactions of carbonyl compounds are examined. This activity highlights the large differences in energies between the isomeric enol and carbonyl forms of simple aldehydes, ketones, esters, and amides. The computed energy values are used to calculate equilibrium constants for keto–enol tautomerization to further underscore the thermodynamic preference for the carbonyl forms. The results from student data support the thermodynamic enol produced by asymmetric ketones and reinforce the reactivity trends for aldehydes, ketones, esters, and amides.
酮烯醇同分异构对于理解许多有机反应和生化转化的机理至关重要。烯醇与羰基化合物的异构化通常是在讨论水与炔烃的酸催化亲电加成反应时介绍的。在研究羰基化合物的反应时,会更详细地讨论羰基化合物与烯醇异构体的同分异构现象。这项活动强调了简单醛、酮、酯和酰胺的烯醇异构体和羰基异构体之间能量的巨大差异。计算得出的能值用于计算酮烯醇同分异构的平衡常数,从而进一步强调羰基形式的热力学偏好。学生数据的结果支持不对称酮产生的热力学烯醇,并加强了醛、酮、酯和酰胺的反应趋势。
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引用次数: 0
Implementation of Smartphone-Assisted Colorimetric Assay for Metabolite Measurement in Plant Extract: An Example of Controlled Release from a Polymer Matrix 利用智能手机辅助比色法测量植物提取物中的代谢物:聚合物基质控释的一个实例
IF 3 3区 教育学 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-06-20 DOI: 10.1021/acs.jchemed.4c00368
Adrián Matencio, Valentina Brunella, Francesco Trotta
Students’ use of mobile phones has become common during their free time. Moreover, they can allow them to show advanced concepts and expand the capacity of high schools with limited resources. In this activity, high school students have used their mobile phones and two free applications to study the quantification and calibration of a natural extract of betalains obtained by themselves from beetroots. The extract was made after cut, grinding, and separated from the lipidic fraction with petroleum ether. Using a standard, their phones, and various dilutions, the students obtained a calibration plot (R2 ≈ 0.95) and the concentration of the extract. Finally, using the spherification technique in calcium alginate, the concept of controlled release of drugs and/or nutraceuticals was shown with excellent results. This work opens the doors to expand the capabilities of educational centers in their laboratories and the possibility of using colorimetry of complex food matrices.
学生在课余时间使用手机已成为一种普遍现象。此外,手机还能让他们展示先进的理念,扩大资源有限的高中的能力。在这次活动中,高中生利用手机和两个免费应用程序,研究了自己从甜菜中提取的天然桦木素的定量和校准问题。这种提取物是经过切割、研磨并用石油醚从脂质部分中分离出来的。学生们使用标准品、他们的手机和各种稀释液,得到了校准图(R2 ≈ 0.95)和提取物的浓度。最后,利用海藻酸钙的球化技术,展示了药物和/或营养保健品的控释概念,并取得了很好的效果。这项工作为扩大教育中心实验室的能力和使用复杂食品基质比色法的可能性打开了大门。
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引用次数: 0
Assignment of Regioisomers Using Infrared Spectroscopy: A Python Coding Exercise in Data Processing and Machine Learning 利用红外光谱鉴定 Regioisomers:数据处理和机器学习中的 Python 编码练习
IF 3 3区 教育学 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-06-19 DOI: 10.1021/acs.jchemed.4c00295
Samuel T. Cahill, Joseph E. B. Young, Max Howe, Ryan Clark, Andrew F. Worrall, Malcolm I. Stewart
Machine learning is a set of tools that are increasingly used in the field of chemistry. The introduction of potential uses of machine learning to undergraduate chemistry students should help to increase their comprehension of and interest in machine learning processes and can help support them in their transition into graduate research and industrial environments that use such tools. Herein we present an exercise aimed at introducing machine learning alongside improving students’ general Python coding abilities. The exercise aims to identify the regioisomerism of disubstituted benzene systems solely from infrared spectra, a simple and ubiquitous undergraduate technique. The exercise culminates in students collecting their own spectra of compounds with unknown regioisomerism and predicting the results, allowing them to take ownership of their results and creating a larger database of information to draw upon for machine learning in the future.
机器学习是一套在化学领域应用日益广泛的工具。向化学专业本科生介绍机器学习的潜在用途,应有助于提高他们对机器学习过程的理解和兴趣,并为他们过渡到使用此类工具的研究生研究和工业环境提供支持。在此,我们介绍一个练习,旨在介绍机器学习,同时提高学生的 Python 编程能力。该练习旨在仅通过红外光谱(一种简单而普遍的本科生技术)来识别二取代苯体系的区域异构性。练习的最终目的是让学生自己收集具有未知区域异构性的化合物的光谱并预测结果,从而让他们掌握自己的结果,并创建一个更大的信息数据库,供将来的机器学习使用。
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引用次数: 0
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Journal of Chemical Education
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