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Density Matrix Renormalization Group (DMRG)-based Approaches in Computational Chemistry

Density Matrix Renormalization Group (DMRG)-based Approaches in Computational Chemistry outlines important theories and algorithms of DMRG;

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Frontiers In Quantum Information Research - Proceedings Of The Summer School On Decoherence, Entanglement & Entropy And Proceedings Of The Workshop On Mps & Dmrg

(matrix product states) & DMRG (density matrix renormalization group). Subjects of the summer school include introduction to MPS, black holes;

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Mathematical Physics in Theoretical Chemistry

include density functional theory, computational methods in biological chemistry, and Hartree-Fock methods. As the second volume in the;

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Computational Medicinal Chemistry for Drug Discovery

function-based quantum chemistry, density functional theory, 3-D structure generation, and hybrid methods.;

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Computational Chemistry Methodology in Structural Biology and Materials Sciences

to bioactive molecules. It looks at various aspects of density functional theory and other issues. Part 2, on Computational Chemistry;

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Computational Chemistry Methodology in Structural Biology and Materials Sciences

to bioactive molecules. It looks at various aspects of density functional theory and other issues. Part 2, on Computational Chemistry;

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Understanding Density Matrices

explored using the density-matrix renormalization-group method. In the closing chapter, the mathematical methods of the description of the;

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Statistical Mechanics

In a comprehensive treatment of Statistical Mechanics from thermodynamics through the renormalization group, this book serves as the core;

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Reviews in Computational Chemistry, Volume 32

REVIEWS IN COMPUTATIONAL CHEMISTRY THE LATEST VOLUME IN THE REVIEWS IN COMPUTATIONAL CHEMISTRY SERIES, THE INVALUABLE REFERENCE TO METHODS;

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Reviews in Computational Chemistry, Volume 14

CONSIDER TO BE THE CENTRAL CORE OF COMPUTATIONAL CHEMISTRY. TUTORIALS AND REVIEWS COVER HOW TO OBTAIN SIMPLE CHEMICAL INSIGHT AND CONCEPTS FROM;

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Electronic Structure Calculations for Solids and Molecules

properties of matter. This 2006 graduate textbook describes the main theoretical approaches and computational techniques, from the simplest;

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A Matter of Density

Electron density is one of the fundamental concepts underpinning modern chemistry, and this book presents a conceptual treatment of the;

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Computational Organic Chemistry

Building upon and updating the successful first edition, the second edition of Computational Organic Chemistry introduces computational;

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New Horizons in Density Functional Theory

Density functional theory (DFT) is today's most widely used method for practical computational electronic structure calculations across;

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Computational Quantum Chemistry

Computational Quantum Chemistry presents computational electronic structure theory as practised in terms of ab initio waveform methods and;

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Electronic Structure Calculations

Slater type basis functions, plane waves, wavelets and real-space grid-based approaches. The chapters expose details on the calculation of two;

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Handbook of Computational Quantum Chemistry

explanations.Written in a straightforward and accessible manner, this Handbook of Computational Quantum Chemistry encompasses such topics;

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A Mathematical Introduction to Electronic Structure Theory

structure calculations: density matrix based algorithms and linear response theory. Chapter 2 introduces the Kohn-Sham density functional theory;

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Density Matrix Method And Femtosecond Processes

State University. It is prepared at a level intended for chemistry and physics graduate students.;

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Computational Organometallic Chemistry

This work provides a how-to approach to the fundamentals, methodologies and dynamics of computational organometallic chemistry, including;

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Computational Organometallic Chemistry

This work provides a how-to approach to the fundamentals, methodologies and dynamics of computational organometallic chemistry, including;

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Modeling of Molecular Properties

computational chemistry. The 28 chapters, written by an international group of experienced theoretically oriented chemists, are grouped into four parts;

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Quantum Gravity and the Functional Renormalization Group

volume provides a self-contained pedagogical introduction to asymptotic safety, and introduces the functional renormalization group techniques;

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An Introduction to Computational Physics

dealing with basic computational tools and routines, covering approximating functions, differential equations, spectral analysis, and matrix;

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An Introduction to Computational Physics

dealing with basic computational tools and routines, covering approximating functions, differential equations, spectral analysis, and matrix;

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Reviews in Computational Chemistry

fields of computational chemistry. Topics in Volume 29 include: * Noncovalent Interactions in Density-Functional Theory * Long-Range Inter;

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Direct Hydroxylation of Methane

This book focuses on theoretical and computational studies by the editor's group on the direct hydroxylation of methane, which is one;

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