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Molecular Physical Chemistry: A Computer-based Approach using Mathematica(R) and Gaussian - Jose J.C. Teixeira-Dias January 25, 2017 PDF  BOOKS
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Molecular Physical Chemistry: A Computer-based Approach using Mathematica(R) and Gaussian
Author: Jose J.C. Teixeira-Dias
Year: January 25, 2017
Format: PDF
File size: PDF 13 MB
Language: English



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Molecular Physical Chemistry: A Computer-Based Approach Using MathematicaR and Gaussian = As we continue to advance in our understanding of the world around us, it is becoming increasingly clear that technology will play a crucial role in shaping the future of humanity. The rapid pace of technological evolution has led to the development of modern knowledge, which is essential for survival in today's warring state. However, this evolution is not just about machines and algorithms but also about developing a personal paradigm for perceiving the technological process. This book, "Molecular Physical Chemistry: A Computer-Based Approach Using MathematicaR and Gaussian is a testament to this idea. It offers a unique approach to physical chemistry education by presenting the subject matter on the basis of examples, exploring computer programs, and encouraging active learning. The book is designed for students in their second year of chemistry master's studies and beyond, providing both basic and advanced knowledge in seven chapters. Each chapter covers thermodynamics, chemical kinetics, quantum mechanics, and molecular structure, with an introduction to quantum chemical calculations, molecular symmetry, and crystals. The text emphasizes the application of physical chemical knowledge and problem-solving, using water as an example to demonstrate the treatment of both the water molecule and water in condensed phases.
Molecular Physical Chemistry: A Computer-Based Approach Using MathematicaR and Gaussian = По мере того, как мы продолжаем продвигаться в нашем понимании окружающего мира, становится все более очевидным, что технологии будут играть решающую роль в формировании будущего человечества. Быстрые темпы технологической эволюции привели к развитию современных знаний, которые необходимы для выживания в современном воюющем государстве. Однако эта эволюция касается не только машин и алгоритмов, но и разработки личной парадигмы восприятия технологического процесса. Книга «Molecular Physical Chemistry: A Computer-Based Approach Using MathematicaR and Gaussian» является свидетельством этой идеи. Он предлагает уникальный подход к физическому химическому образованию, представляя предмет на основе примеров, исследуя компьютерные программы и поощряя активное обучение. Книга предназначена для студентов второго года обучения в магистратуре по химии и далее, предоставляя как базовые, так и расширенные знания в семи главах. Каждая глава охватывает термодинамику, химическую кинетику, квантовую механику и молекулярную структуру, с введением в квантово-химические вычисления, молекулярную симметрию и кристаллы. В тексте подчеркивается применение физико-химических знаний и решение проблем на примере воды для демонстрации обработки как молекулы воды, так и воды в конденсированных фазах.
Molecular Physical Chemistry : A Computer-Based Approach Using MathematicaR and Gaussian = Alors que nous continuons à progresser dans notre compréhension du monde qui nous entoure, il est de plus en plus évident que la technologie jouera un rôle décisif dans la formation de l'avenir de l'humanité. rythme rapide de l'évolution technologique a conduit au développement des connaissances modernes nécessaires à la survie dans l'État combattant moderne. Cependant, cette évolution ne concerne pas seulement les machines et les algorithmes, mais aussi le développement d'un paradigme personnel de perception du processus technologique. livre « Molecular Physical Chemistry : A Computer-Based Approach Using MathematicaR and Gaussian » témoigne de cette idée. Il propose une approche unique de l'éducation physique en chimie, en présentant un sujet basé sur des exemples, en explorant des programmes informatiques et en encourageant l'apprentissage actif. livre est destiné aux étudiants de deuxième année de maîtrise en chimie et au-delà, fournissant à la fois des connaissances de base et avancées dans sept chapitres. Chaque chapitre couvre la thermodynamique, la cinétique chimique, la mécanique quantique et la structure moléculaire, avec une introduction aux calculs quantiques et chimiques, à la symétrie moléculaire et aux cristaux. texte met l'accent sur l'application des connaissances physico-chimiques et la résolution des problèmes avec l'exemple de l'eau pour démontrer le traitement de la molécule d'eau et de l'eau dans les phases condensées.
Molecular Physical Chemistry: A Computer-Based Approach Using MathematicaR and Gaussian = A medida que seguimos avanzando en nuestra comprensión del mundo que nos rodea, es cada vez más evidente que la tecnología jugará un papel crucial en la formación el futuro de la humanidad. rápido ritmo de la evolución tecnológica ha conducido al desarrollo de conocimientos modernos que son esenciales para la supervivencia en un Estado en guerra moderno. n embargo, esta evolución no solo concierne a máquinas y algoritmos, sino también al desarrollo de un paradigma personal de percepción del proceso tecnológico. libro Molecular Physical Chemistry: A Computer-Based Approach Using MathematicaR and Gaussian es un testimonio de esta idea. Ofrece un enfoque único de la educación química física, presentando la materia a partir de ejemplos, investigando programas informáticos y fomentando el aprendizaje activo. libro está dirigido a estudiantes de segundo año de maestría en Química en adelante, proporcionando conocimientos tanto básicos como avanzados en siete capítulos. Cada capítulo abarca la termodinámica, la cinética química, la mecánica cuántica y la estructura molecular, con introducción en los cálculos cuántico-químicos, la simetría molecular y los cristales. texto destaca la aplicación del conocimiento físico-químico y la resolución de problemas con el ejemplo del agua para demostrar el tratamiento tanto de la molécula de agua como de la de agua en fases condensadas.
Molecular Physical Chemistry: A Computer-Based Approach Using MathematicaR and Gaussian = Während wir unser Verständnis der Welt um uns herum weiterentwickeln, wird immer deutlicher, dass Technologie die Zukunft der Menschheit entscheidend mitgestalten wird. Das schnelle Tempo der technologischen Entwicklung hat zur Entwicklung des modernen Wissens geführt, das für das Überleben im modernen Kriegsstaat notwendig ist. Diese Entwicklung betrifft jedoch nicht nur Maschinen und Algorithmen, sondern auch die Entwicklung eines persönlichen Paradigmas der Prozesswahrnehmung. Das Buch „Molecular Physical Chemistry: A Computer-Based Approach Using MathematicaR and Gaussian“ ist ein Beweis für diese Idee. Es bietet einen einzigartigen Ansatz für die physikalische chemische Ausbildung, indem es das Thema anhand von Beispielen präsentiert, Computerprogramme erforscht und aktives rnen fördert. Das Buch richtet sich an Studierende des zweiten Studienjahres im Master in Chemie und darüber hinaus und vermittelt in sieben Kapiteln sowohl Grund- als auch fortgeschrittene Kenntnisse. Jedes Kapitel umfasst Thermodynamik, chemische Kinetik, Quantenmechanik und molekulare Struktur mit einer Einführung in quantenchemische Berechnungen, molekulare Symmetrie und Kristalle. Der Text betont die Anwendung von physikalisch-chemischem Wissen und Problemlösung am Beispiel von Wasser, um die Behandlung sowohl des Wassermoleküls als auch des Wassers in kondensierten Phasen zu demonstrieren.
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Moleküler Fiziksel Kimya: MathematicaR ve Gaussian Kullanarak Bilgisayar Tabanlı Bir Yaklaşım = Çevremizdeki dünyayı anlamada ilerlemeye devam ettikçe, teknolojinin insanlığın geleceğini şekillendirmede kritik bir rol oynayacağı giderek daha açık hale geliyor. Teknolojik evrimin hızlı hızı, modern bir savaşan devlette hayatta kalmak için gerekli olan modern bilginin gelişmesine yol açmıştır. Bununla birlikte, bu evrim sadece makineleri ve algoritmaları değil, aynı zamanda teknolojik bir sürecin algılanması için kişisel bir paradigmanın geliştirilmesini de ilgilendirmektedir. Moleküler Fiziksel Kimya: MathematicaR ve Gaussian Kullanarak Bilgisayar Tabanlı Bir Yaklaşım bu fikrin bir kanıtıdır. Fiziksel kimya eğitimine, örneklere dayalı bir konu sunarak, bilgisayar programlarını keşfederek ve aktif öğrenmeyi teşvik ederek benzersiz bir yaklaşım sunar. Kitap, kimya ve ötesindeki yüksek lisans programındaki ikinci sınıf öğrencilerine yöneliktir ve yedi bölümde hem temel hem de ileri düzeyde bilgi sağlar. Her bölüm termodinamik, kimyasal kinetik, kuantum mekaniği ve moleküler yapıyı, kuantum kimyasal hesaplama, moleküler simetri ve kristallere giriş ile kapsar. Metin, yoğunlaştırılmış fazlarda hem bir su molekülünün hem de suyun arıtılmasını göstermek için su örneğini kullanarak fizikokimyasal bilginin ve problem çözmenin uygulanmasını vurgular.
الكيمياء الفيزيائية الجزيئية: نهج قائم على الكمبيوتر باستخدام الرياضيات والغاوسي = بينما نواصل التقدم في فهمنا للعالم من حولنا، أصبح من الواضح بشكل متزايد أن التكنولوجيا ستلعب دورًا حاسمًا في تشكيل مستقبل البشرية. أدت الوتيرة السريعة للتطور التكنولوجي إلى تطوير المعرفة الحديثة، وهي ضرورية للبقاء في حالة حرب حديثة. ومع ذلك، فإن هذا التطور لا يتعلق فقط بالآلات والخوارزميات، ولكن أيضًا بتطوير نموذج شخصي لتصور العملية التكنولوجية. الكيمياء الفيزيائية الجزيئية: نهج قائم على الكمبيوتر باستخدام MathematicaR و Gaussian هو شهادة على هذه الفكرة. يقدم نهجًا فريدًا لتعليم الكيمياء الفيزيائية من خلال تقديم موضوع يعتمد على الأمثلة واستكشاف برامج الكمبيوتر وتشجيع التعلم النشط. الكتاب مخصص لطلاب السنة الثانية في برنامج الماجستير في الكيمياء وخارجها، حيث يوفر المعرفة الأساسية والمتقدمة في سبعة فصول. يغطي كل فصل الديناميكا الحرارية والحركية الكيميائية وميكانيكا الكم والبنية الجزيئية، مع مقدمة للحساب الكيميائي الكمي والتماثل الجزيئي والبلورات. يؤكد النص على تطبيق المعرفة الفيزيائية الكيميائية وحل المشكلات باستخدام مثال الماء لإثبات معالجة كل من جزيء الماء والماء في المراحل المكثفة.

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