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Sholl, David - Density Functional Theory: A Practical Introduction, ebook

Density Functional Theory: A Practical Introduction

Sholl, David

88,35€

Demonstrates how anyone in math, science, and engineering can master DFT calculations
Density functional theory (DFT) is one of the most frequently used computational tools for studying and predicting the properties of isolated molecules, bulk solids,

Sahni, Viraht - Quantal Density Functional Theory, ebook

Quantal Density Functional Theory

Sahni, Viraht

122,75€

Schrödinger Theory from the ‘Newtonian’ Perspective of ‘Classical’ Fields Derived from Quantal Sources
Viraht Sahni
3. Quantal Density Functional Theory
Viraht Sahni
4.

Dreizler, Reiner M. - Density Functional Theory, ebook

Density Functional Theory

Dreizler, Reiner M.

135,25€

Foundations of Density Functional Theory: Existence Theorems
Eberhard Engel, Reiner M. Dreizler
3. Effective Single-Particle Equations
Eberhard Engel, Reiner M. Dreizler
4. Exchange-Correlation Energy Functional

Sholl, David - Density Functional Theory : A Practical Introduction, ebook

Density Functional Theory : A Practical Introduction

Sholl, David

88,35€

Demonstrates how anyone in math, science, and engineering can master DFT calculations
Density functional theory (DFT) is one of the most frequently used computational tools for studying and predicting the properties of isolated molecules, bulk solids, and material interfaces, including surfaces. Although the theoretical

Holthausen, Max C. - A Chemist's Guide to Density Functional Theory, ebook

A Chemist's Guide to Density Functional Theory

Holthausen, Max C.

96,60€

"Chemists familiar with conventional quantum mechanics will applaud and benefit greatly from this particularly instructive, thorough and clearly written exposition of density functional theory: its basis, concepts, terms, implementation, and performance

Aldecoa, Rafael Tiedra de - Spectral Theory and Mathematical Physics, ebook

Spectral Theory and Mathematical Physics

Aldecoa, Rafael Tiedra de

136,40€

Some Estimates Regarding Integrated Density of States for Random Schrödinger Operator with Decaying Random Potentials
Dhriti Ranjan Dolai
8. Boundary Values of Resolvents of Self-adjoint Operators in Krein Spaces and Applications to the Klein–Gordon Equation

Bachrach, Steven M. - Computational Organic Chemistry, ebook

Computational Organic Chemistry

Bachrach, Steven M.

110,20€

New coverage includes: significant problems with standard DFT (density functional theory) methods; ways to address these problems; computational organic spectroscopy; computational tools for understanding enzyme mechanisms; and