Quantum & theoretical chemistry books

2044 books were found.

The Mathematical Principles of Scale Relativity Physics: The Concept of Interpretation

The Mathematical Principles of Scale Relativity Physics:...

Author: Nicolae Mazilu ,  Maricel Agop (Thechnical University “Gh.Asachi” Iasi, Romania)
ISBN: 9780367349349
Format: Hardback
$347.00

This book explores and builds upon the principles of Laurent Nottale’s scale relativity. It provides a unified framework...  Read More >>

Atomic Structure and Chemical Bond: A Problem Solving Approach

Atomic Structure and Chemical Bond: A Problem Solving...

Author: Manas Chanda
ISBN: 9789386768360
Format: Paperback
$103.37

Covering most of the topics taught in university courses in quantum chemistry, this authoritative text provides...  Read More >>

High Performance Computing in Science and Engineering ' 18: Transactions of the High Performance Computing Center, Stuttgart (HLRS) 2018

High Performance Computing in Science and Engineering...

Author: Wolfgang E. Nagel ,  Dietmar H. Kröner
ISBN: 9783030133245
Format: Hardback
$336.35

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

Chemical Reactions: Basic Theory and Computing

Chemical Reactions: Basic Theory and Computing

Author: Antonio Laganà ,  Gregory A. Parker
ISBN: 9783319872995
Format: Paperback
$184.77

This graduate textbook, written by experienced lecturers, features the study and computation of efficient reactive...  Read More >>

Advances in Computational Toxicology: Methodologies and Applications in Regulatory Science

Advances in Computational Toxicology: Methodologies...

Author: Huixiao Hong
ISBN: 9783030164423
Format: Hardback
$527.97

This book provides a comprehensive review of both traditional and cutting-edge methodologies that are currently...  Read More >>

Time-Dependent Density-Functional Theory: Concepts and Applications

Time-Dependent Density-Functional Theory: Concepts and...

Author: Carsten A. Ullrich (Department of Physics and Astronomy, University of Missouri - Columbia)
ISBN: 9780198841937
Format: Paperback
$90.95

Time-dependent density-functional theory (TDDFT) is a quantum mechanical approach for the dynamical properties of...  Read More >>

Low-Energy Electrons: Fundamentals and Applications

Low-Energy Electrons: Fundamentals and Applications...

Author: Oddur Ingólfsson
ISBN: 9789814800006
Format: Hardback
$359.66

Published in 2019, Low-energy electrons are ubiquitous in nature and play an important role in natural phenomena...  Read More >>

The Structure Dependent Energy of Organic Compounds

The Structure Dependent Energy of Organic Compounds...

Author: Árpád Furka
ISBN: 9783030060039
Format: Paperback
$158.37

This brief introduces readers to an alternative thermochemical reference system that makes it possible to use the...  Read More >>

Computerapplikationen in der Mitteldeutschen Chemieregion – ein historischer Abriss

Computerapplikationen in der Mitteldeutschen Chemieregion...

Author: Bernhard Adler
ISBN: 9783662590553
Format: Paperback
$105.57

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A Different Thermodynamics and its True Heroes

A Different Thermodynamics and its True Heroes

Author: Evgeni B. Starikov
ISBN: 9789814774918
Format: Hardback
$258.75

This book pays the due tribute to those scientists whose contribution to the field of thermodynamics is undoubtedly...  Read More >>

Transition Metals in Coordination Environments: Computational Chemistry and Catalysis Viewpoints

Transition Metals in Coordination Environments: Computational...

Author: Ewa Broclawik ,  Tomasz Borowski
ISBN: 9783030117139
Format: Hardback
$448.77

This book focuses on the electronic properties of transition metals in coordination environments. As such, the book...  Read More >>

High Performance Computing in Science and Engineering ' 17: Transactions of the High Performance Computing Center, Stuttgart (HLRS) 2017

High Performance Computing in Science and Engineering...

Author: Wolfgang E. Nagel ,  Dietmar H. Kröner
ISBN: 9783319885957
Format: Paperback
$580.77

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

Boron: The Fifth Element

Boron: The Fifth Element

Author: Drahomír Hnyk ,  Michael McKee
ISBN: 9783319793887
Format: Paperback
$448.77

This multi-author edited volume reviews the recent developments in boron chemistry, with a particular emphasis on...  Read More >>

Computational Approaches for Chemistry Under Extreme Conditions

Computational Approaches for Chemistry Under Extreme...

Author: Nir Goldman
ISBN: 9783030055998
Format: Hardback
$369.57

It delves into cutting edge developments in simulation methods for reactive materials, including quantum calculations...  Read More >>

Foundations of Chemical Reaction Network Theory

Foundations of Chemical Reaction Network Theory

Author: Martin Feinberg
ISBN: 9783030038571
Format: Hardback
$422.37

This book provides an authoritative introduction to the rapidly growing field of chemical reaction network theory....  Read More >>

Flash Computation and EoS Modelling for Compositional Thermal Simulation of Flow in Porous Media

Flash Computation and EoS Modelling for Compositional...

Author: Duncan Paterson
ISBN: 9783030117863
Format: Hardback
$290.37

Further, it provides an effective solution for multiphase isenthalpic flash under the classical framework, and it...  Read More >>

Mathematical Physical Chemistry: Practical and Intuitive Methodology

Mathematical Physical Chemistry: Practical and Intuitive...

Author: Shu Hotta
ISBN: 9789811356674
Format: Paperback
$659.97

This book introduces basic concepts of mathematical physics to chemists. This approach helps chemists understand...  Read More >>

Topological Matter: Lectures from the Topological Matter School 2017

Topological Matter: Lectures from the Topological Matter...

Author: Dario Bercioux ,  Jérôme Cayssol
ISBN: 9783030094775
Format: Paperback
$343.17

This book covers basic and advanced aspects in the field of Topological Matter. It provides graduate level content...  Read More >>

On-Surface Synthesis II: Proceedings of the International Workshop On-Surface Synthesis, San Sebastián, 27-30 June 2016

On-Surface Synthesis II: Proceedings of the International...

Author: Dimas G. de Oteyza ,  Celia Rogero
ISBN: 9783030093310
Format: Paperback
$448.77

On-surface synthesis is appearing as an extremely promising strategy to create organic nanoarchitectures with atomic...  Read More >>

Contributions to Partial Differential Equations and Applications

Contributions to Partial Differential Equations and...

Author: B. N. Chetverushkin ,  W. Fitzgibbon
ISBN: 9783030086756
Format: Paperback
$232.85

It includes the mathematical and numerical contributions to PDE for applications presented at the ECCOMAS thematic...  Read More >>

Computational Materials Science: From Ab Initio to Monte Carlo Methods

Computational Materials Science: From Ab Initio to Monte...

Author: Kaoru Ohno ,  Keivan Esfarjani
ISBN: 9783662585870
Format: Paperback
$263.97

This textbook introduces modern techniques based on computer simulation to study materials science. Readers will...  Read More >>

X-ray Nanochemistry: Concepts and Development

X-ray Nanochemistry: Concepts and Development

Author: Ting Guo
ISBN: 9783030085964
Format: Paperback
$290.37

This book describes the latest developments in the new research discipline of X-ray nanochemistry, which uses nanomaterials...  Read More >>

Photochemistry: A Modern Theoretical Perspective

Photochemistry: A Modern Theoretical Perspective

Author: Maurizio Persico ,  Giovanni Granucci
ISBN: 9783030079062
Format: Paperback
$171.57

This book offers an introduction to photochemistry for students with a minimal background in physical chemistry...  Read More >>

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