| 书目名称 | Molecular Physical Chemistry | | 副标题 | A Computer-based App | | 编辑 | José J. C. Teixeira-Dias | | 视频video | | | 概述 | Creates an active learning environment, using computer-based problem solving, illustrated with a wealth of examples and exercises.Explains basic and advanced concepts in thermodynamics, chemical kinet | | 图书封面 |  | | 描述 | This is .the. physical chemistry textbook for students with an affinity for computers! It offers basic and advanced knowledge for students in the second year of chemistry masters studies and beyond. In seven chapters, the book presents thermodynamics, chemical kinetics, quantum mechanics and molecular structure (including an introduction to quantum chemical calculations), molecular symmetry and crystals. The application of physical-chemical knowledge and problem solving is demonstrated in a chapter on water, treating both the water molecule as well as water in condensed phases..Instead of a traditional textbook top-down approach, this book presents the subjects on the basis of examples, exploring and running computer programs (Mathematica®), discussing the results of molecular orbital calculations (performed using Gaussian) on small molecules and turning to suitable reference works to obtain thermodynamic data. Selected Mathematica® codes are explained at the end of each chapter and cross-referenced with the text, enabling students to plot functions, solve equations, fit data, normalize probability functions, manipulate matrices and test physical models. In addition, the book prese | | 出版日期 | Textbook 2017 | | 关键词 | Physical chemistry textbook; Physical chemistry with the computer; Chemical thermodynamics and reactio | | 版次 | 1 | | doi | https://doi.org/10.1007/978-3-319-41093-7 | | isbn_softcover | 978-3-319-82265-5 | | isbn_ebook | 978-3-319-41093-7 | | copyright | Springer International Publishing Switzerland 2017 |
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发表于 2025-3-21 17:49:49
