Density functional theory advances (10 Ergebnisse)

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Zustand: New. This is a Brand-new US Edition. This Item may be shipped from US or any other country as we have multiple locations worldwide.

Zustand: New. In English.

Zustand: New.

Zustand: New. In English.

Hardcover. Zustand: Brand New. 1st edition. 216 pages. 9.45x6.69x0.71 inches. In Stock.

Zustand: New. In English.

Zustand: Hervorragend. Zustand: Hervorragend | Seiten: 330 | Sprache: Englisch | Produktart: Bücher | Density Functional Theory (DFT) is a powerful technique for calculating and comprehending the molecular and electrical structure of atoms, molecules, clusters, and solids. Its use is based not only on the capacity to calculate the molecular characteristics of the species of interest but also on the provision of interesting concepts that aid in a better understanding of the chemical reactivity of the systems under study. This book presents examples of recent advances, new perspectives, and applications of DFT for the understanding of chemical reactivity through descriptors forming the basis of Conceptual DFT as well as the application of the theory and its related computational procedures in the determination of the molecular properties of different systems of academic, social, and industrial interest.…

Buch. Zustand: Neu. Druck auf Anfrage Neuware - Printed after ordering - DFT methods are widely used in a broad range of disciplines to investigate many body systems. This book provides an overview on contemporary applications of the Density Functional Theory in various fields as computational chemistry, physics or engineering.…

Zustand: New. 2018. Hardcover. . . . . . Books ship from the US and Ireland.