| Subject |
Physics / Quantum Theory, Physics / Polymer, Energy, Chemistry / Analytic, Physics / Atomic & Molecular, Chemistry / Inorganic |
| Synopsis |
Computational chemistry is a science that allows researchers to study, characterize and predict the structure and stability of chemical systems. Structural Analysis using Computational Chemistry arises from the need to present the progress of computational chemistry in various application areas, Computational chemistry is a science that allows researchers to study, characterize and predict the structure and stability of chemical systems. In other words: studying energy differences between different states to explain spectroscopic properties and reaction mechanisms at the atomic level. This field is gaining in relevance and strength due to field applications from chemical engineering, electrical engineering, electronics, biomedicine, biology, materials science, to name but a few. Structural Analysis using Computational Chemistry arises from the need to present the progress of computational chemistry in various application areas. Technical topics discussed in the book include: Quantum mechanics and structural molecular study (AM1) Application of quantum models in molecular analysis Molecular analysis of insulin through controlled adsorption in hydrogels based on chitosan Analysis and molecular characterization of organic materials for application in solar cells Determination of thermodynamic properties of ionic liquids through molecular simulation, Structural Analysis using Computational Chemistry arises from the need to present the progress of computational chemistry in various application areas., Computational chemistry is a science that allows researchers to study, characterize and predict the structure and stability of chemical systems. In other words: studying energy differences between different states to explain spectroscopic properties and reaction mechanisms at the atomic level. This field is gaining in relevance and strength due to field applications from chemical engineering, electrical engineering, electronics, biomedicine, biology, materials science, to name but a few. Structural Analysis Using Computational Chemistry arises from the need to present the progress of computational chemistry in various application areas. Technical topics discussed in the book include: - Quantum mechanics and structural molecular study (AM1) - Application of quantum models in molecular analysis - Molecular analysis of insulin through controlled adsorption in hydrogels based on chitosan - Analysis and molecular characterization of organic materials for application in solar cells - Determination of thermodynamic properties of ionic liquids through molecular simulation, Computational chemistry is a science that allows researchers to study, characterize and predict the structure and stability of chemical systems. In other words: studying energy differences between different states to explain spectroscopic properties and reaction mechanisms at the atomic level. This field is gaining in relevance and strength due to field applications from chemical engineering, electrical engineering, electronics, biomedicine, biology, materials science, to name but a few. Structural Analysis using Computational Chemistry arises from the need to present the progress of computational chemistry in various application areas. Technical topics discussed in the book include: * Quantum mechanics and structural molecular study (AM1)* Application of quantum models in molecular analysis* Molecular analysis of insulin through controlled adsorption in hydrogels based on chitosan* Analysis and molecular characterization of organic materials for application in solar cells* Determination of thermodynamic properties of ionic liquids through molecular simulation, Computational chemistry is a science that allows researchers to study, characterize and predict the structure and stability of chemical systems. In other words: studying energy differences between different states to explain spectroscopic properties and reaction mechanisms at the atomic level. This field is gaining in relevance and strength due to field applications from chemical engineering, electrical engineering, electronics, biomedicine, biology, materials science, to name but a few. Structural Analysis using Computational Chemistry arises from the need to present the progress of computational chemistry in various application areas. Technical topics discussed in the book include: - Quantum mechanics and structural molecular study (AM1)- Application of quantum models in molecular analysis- Molecular analysis of insulin through controlled adsorption in hydrogels based on chitosan- Analysis and molecular characterization of organic materials for application in solar cells- Determination of thermodynamic properties of ionic liquids through molecular simulation |
Samantha Graham
This book is an absolute game-changer for computational chemistry! The author breaks down complex concepts into digestible, practical applications that make structural analysis feel accessible. I've already applied several techniques from the text to my research with impressive results. The hardcover is sturdy and the shipping was incredibly fast. Highly recommended for anyone serious about mastering computational methods!