Ihre Suche nach "Density Functional Theory" ergab 7 Treffer

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: Density Functional Theory, Buch

Density Functional Theory

Mathematics and Molecular Modeling

Density functional theory (DFT) provides the most widely used models for simulating molecules and materials based on the fundamental laws of quantum mechanics. It plays a central role in a huge spectrum o…

lieferbar innerhalb 2-3 Wochen
Buch
EUR 164,28*
: Electron Density, Buch

Electron Density

Discover theoretical, methodological, and applied perspectives on electron density studies and density functional theory Electron density or the single particle density is a 3D function even for a many-el…

lieferbar in mind. 4 Wochen
Buch
EUR 288,57*
: Exploring Chemical Concepts Through Theory and Computation, Buch

Exploring Chemical Concepts Through Theory and Computation

Deep, theoretical resource on the essence of chemistry, explaining a variety of important concepts including redox states and bond types Exploring Chemical Concepts Through Theory and Computation provides…

sofort lieferbar
Buch
EUR 168,48*
Harrison Labollita: Electronic Structure of Rare-Earth Nickelates from First-Principles, Buch

Harrison Labollita
Electronic Structure of Rare-Earth Nickelates from First-Principles

Springer Theses

This thesis demonstrates the value of theoretical approaches in the discovery of new superconducting materials. It reports a detailed study of the recently discovered nickel-oxide (nickelate) superconduct…

lieferbar innerhalb 2-3 Wochen
Buch
EUR 164,28*
Errol G. Lewars: Computational Chemistry, Buch

Errol G. Lewars
Computational Chemistry

This is the fourth edition of the successful textbook on computational chemistry which continues to provide a comprehensive introduction to the theory and practice of computational chemistry. Notable upda…

lieferbar innerhalb 2-3 Wochen
Buch
EUR 138,67*
Qing-Biao Shen: Equilibrium Compound Nucleus Post-Fission Theory, Buch

Qing-Biao Shen, Ye Tian
Equilibrium Compound Nucleus Post-Fission Theory

This book proposes and develops the equilibrium compound nucleus post-fission theory, a powerful tool for studying the fission process and making numerical calculations of post-fission nuclear data. It be…

lieferbar innerhalb 2-3 Wochen
Buch
EUR 153,32*
Rachid Masrour: Magnetoelectronic, Optical, and Thermoelectric Properties of Perovskite Materials, Buch

Rachid Masrour
Magnetoelectronic, Optical, and Thermoelectric Properties of Perovskite Materials

SpringerBriefs in Materials

This book undertakes an extensive exploration of manganese-based compounds, such as T SrxMnO (T = La, Pr; x = 0.35, 0.25) using density functional theory and Monte Carlo simulations with a focus on und…

lieferbar innerhalb 2-3 Wochen
Buch
EUR 43,80*
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