Quantum & theoretical chemistry books

2044 books were found.

Systems, Patterns and Data Engineering with Geometric Calculi

Systems, Patterns and Data Engineering with Geometric...

Author: Sebastià Xambó-Descamps
ISBN: 9783030744885
Format: Paperback
$343.17

The intention of this collection agrees with the purposes of the homonymous mini-symposium (MS) at ICIAM-2019, which...  Read More >>

Proceedings of the 7th International Conference on the Applications of Science and Mathematics 2021: Sciemathic 2021

Proceedings of the 7th International Conference on the...

Author: Aida Binti Mustapha ,  Suhadir Shamsuddin
ISBN: 9789811689024
Format: Hardback
$465.72

This book presents peer-reviewed articles and recent advances on the potential applications of Science and Mathematics...  Read More >>

Ferroelectric Perovskites for High-Speed Memory: A Mechanism Revealed by Quantum Bonding Motion

Ferroelectric Perovskites for High-Speed Memory: A Mechanism...

Author: Taku Onishi
ISBN: 9789811926686
Format: Hardback
$336.35

This book is intended for theoretical and experimental researchers who are interested in ferroelectrics and advanced...  Read More >>

New Horizons in Computational Chemistry Software

New Horizons in Computational Chemistry Software

Author: Michael Filatov ,  Cheol H. Choi
ISBN: 9783031076572
Format: Hardback
$646.85

This volume presents the current status of software development in the field of computational and theoretical chemistry...  Read More >>

Quantum Mechanics: Detailed Historical, Mathematical and Computational Approaches

Quantum Mechanics: Detailed Historical, Mathematical...

Author: Caio Lima Firme (Federal University of Rio Grande do Norte, Brazil)
ISBN: 9780367506339
Format: Hardback
$378.00

Derivation of all important equations of Quantum Mechanics, for example, Heisenberg’s uncertainty principle, de...  Read More >>

High Performance Computing in Science and Engineering '19: Transactions of the High Performance Computing Center, Stuttgart (HLRS) 2019

High Performance Computing in Science and Engineering...

Author: Wolfgang E. Nagel ,  Dietmar H. Kröner
ISBN: 9783030667948
Format: Paperback
$448.77

Presenting findings of one of Europe’s leading systems, this volume covers a wide variety of applications that deliver...  Read More >>

Drug Target Selection and Validation

Drug Target Selection and Validation

Author: Marcus T. Scotti ,  Carolina L. Bellera
ISBN: 9783030958947
Format: Hardback
$310.47

The first book in the newly created book series, Computer-Aided Drug Discovery and Design, focuses on the computational...  Read More >>

Philosophical Perspectives in Quantum Chemistry

Philosophical Perspectives in Quantum Chemistry

Author: Olimpia Lombardi ,  Juan Camilo Martínez González
ISBN: 9783030983727
Format: Hardback
$284.60

This book explores the philosophy and the foundations of quantum chemistry. Coverage includes such topics as quantum...  Read More >>

Practical Geochemistry

Practical Geochemistry

Author: Paul Alexandre
ISBN: 9783030724559
Format: Paperback
$116.41

This book is a marked departure from typical introductory geochemistry books available: It provides a simple, straightforward,...  Read More >>

Development of Solar Cells: Theory and Experiment

Development of Solar Cells: Theory and Experiment

Author: Juganta K. Roy ,  Supratik Kar
ISBN: 9783030694470
Format: Paperback
$527.97

This book presents a comprehensive overview of the fundamental concept, design, working protocols, and diverse photo-chemicals...  Read More >>

Glenological Chemistry: The Organisation of Matter

Glenological Chemistry: The Organisation of Matter

Author:
ISBN: 9780951789049
Format: Paperback
$64.69

Reforming Mendeleev's tabular periodic table in a circular form offers many options for reconsidering the basic...  Read More >>

Basis Sets in Computational Chemistry

Basis Sets in Computational Chemistry

Author: Eva Perlt
ISBN: 9783030672645
Format: Paperback
$369.57

This book addresses the construction and application of the major types of basis sets for computational chemistry...  Read More >>

Luminescent Materials: A Quantum Chemical Approach for Computer-Aided Discovery and Design

Luminescent Materials: A Quantum Chemical Approach for...

Author: Zoila Barandiarán ,  Jonas Joos
ISBN: 9783030949839
Format: Hardback
$362.22

This book describes a unique combination of quantum chemical methods for calculating the basic physical properties...  Read More >>

Structural Science of Crystalline Polymers: Basic Concepts and Practices

Structural Science of Crystalline Polymers: Basic Concepts...

Author: Kohji Tashiro
ISBN: 9789811595608
Format: Hardback
$517.47

This book focuses on the modern development of techniques for analysis of the hierarchical structure of polymers...  Read More >>

Photoelectron-Ion Correlation in Photoionization of a Hydrogen Molecule and Molecule-Photon Dynamics in a Cavity

Photoelectron-Ion Correlation in Photoionization of...

Author: Takanori Nishi
ISBN: 9789811917776
Format: Hardback
$413.97

This book presents the latest theoretical studies giving new predictions and interpretations on the quantum correlation...  Read More >>

Enhanced Chitosan Material for Water Treatment: Applications of Multi-Functional Chitosan Derivative

Enhanced Chitosan Material for Water Treatment: Applications...

Author: Ephraim Igberase ,  Peter Ogbemudia Osifo
ISBN: 9783030717247
Format: Paperback
$448.77

This book reviews some of the latest developments in the field of water treatment using multi-functional chitosan-based...  Read More >>

Symmetry in Inorganic and Coordination Compounds: A Student's Guide to Understanding Electronic Structure

Symmetry in Inorganic and Coordination Compounds: A...

Author: Franca Morazzoni
ISBN: 9783030629984
Format: Paperback
$369.57

This book addresses the nature of the chemical bond in inorganic and coordination compounds. In the case of inorganic...  Read More >>

Quantum Chemistry and Computing for the Curious: Illustrated with Python and Qiskit® code

Quantum Chemistry and Computing for the Curious: Illustrated...

Author: Keeper L. Sharkey ,  Alain Chance
ISBN: 9781803243900
Format: Paperback
$93.12

This book is a modern presentation of quantum chemical concepts and how it relates to quantum computing to solve...  Read More >>

Progress in the Chemistry of Organic Natural Products 118

Progress in the Chemistry of Organic Natural Products...

Author: A. Douglas Kinghorn ,  Heinz Falk
ISBN: 9783030920296
Format: Hardback
$388.10

Chapter 3 discusses the defensive chemical ecology of two North American newt species that both produce tetrodotoxin,...  Read More >>

Melanin Chemistry Explored by Quantum Mechanics: Investigations for Mechanism Identification and Reaction Design

Melanin Chemistry Explored by Quantum Mechanics: Investigations...

Author: Ryo Kishida ,  Susan Meñez Aspera
ISBN: 9789811613173
Format: Paperback
$422.37

This book discusses recent advances in theoretical–computational studies on the biosynthesis of melanin pigment...  Read More >>

Multiple Action-Based Design Approaches to Antibacterials

Multiple Action-Based Design Approaches to Antibacterials...

Author: John Bremner
ISBN: 9789811610011
Format: Paperback
$475.17

This book covers intentional design aspects for combinations of drugs, single-molecule hybrids with potential or...  Read More >>

Mathematics for Natural Scientists: Fundamentals and Basics

Mathematics for Natural Scientists: Fundamentals and...

Author: Lev Kantorovich
ISBN: 9783030912215
Format: Paperback
$155.22

This book, now in a second revised and enlarged edition, covers a course of mathematics designed primarily for physics...  Read More >>

From Electrons to Elephants and Elections: Exploring the Role of Content and Context

From Electrons to Elephants and Elections: Exploring...

Author: Shyam Wuppuluri ,  Ian Stewart
ISBN: 9783030921910
Format: Hardback
$258.72

This highly interdisciplinary book, covering more than six fields, from philosophy and sciences all the way up to...  Read More >>

Foundations of Molecular Modeling and Simulation: Select Papers from FOMMS 2018

Foundations of Molecular Modeling and Simulation: Select...

Author: Edward J. Maginn ,  Jeffrey Errington
ISBN: 9789813366411
Format: Paperback
$422.37

This highly informative and carefully presented book comprises select proceedings of Foundation for Molecular Modelling...  Read More >>

Active Particles, Volume 3: Advances in Theory, Models, and Applications

Active Particles, Volume 3: Advances in Theory, Models,...

Author: Nicola Bellomo ,  José Antonio Carrillo
ISBN: 9783030933012
Format: Hardback
$284.60

This edited volume collects six surveys that present state-of-the-art results on modeling, qualitative analysis,...  Read More >>

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