Density Functional Theory Practical by Sholl David (18 results)
- Hardcover
Seller: Books From California, Simi Valley, CA, U.S.A.Books From California
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- Hardcover
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hardcover. Condition: Good. Connecting readers with great books since 1972! Used textbooks may not include companion materials such as access codes, etc. May have some wear or writing/highlighting. We ship orders daily and Customer Service is our top priority.
- Hardcover
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- Hardcover
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- Hardcover
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- Hardcover
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- Hardcover
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- Hardcover
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- Hardcover
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- Hardcover
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Condition: New. 2022. 2nd Edition. Hardback. . . . . .
- Hardcover
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- Hardcover
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- Hardcover
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Condition: New. 2022. 2nd Edition. Hardback. . . . . . Books ship from the US and Ireland.
- Hardcover
Seller: AHA-BUCH GmbH, Einbeck, GermanyAHA-BUCH GmbH
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Buch. Condition: Neu. Neuware - Density Functional TheoryA concise and rigorous introduction to the applications of DFT calculationsIn the newly revised second edition of Density Functional Theory: A Practical Introduction, the authors deliver a concise and easy-to-follow introduction to the key concepts and practical applicatio…ns of density functional theory (DFT) with an emphasis on plane-wave DFT. The authors draw on decades of experience in the field, offering students from a variety of backgrounds a balanced approach between accessibility and rigor, creating a text that is highly digestible in its entirety.This new edition:\* Discusses in more detail the accuracy of DFT calculations and the choice of functionals\* Adds an overview of the wide range of available DFT codes\* Contains more examples on the use of DFT for high throughput materials calculations\* Puts more emphasis on computing phase diagrams and on open ensemble methods widely used in electrochemistry\* Is significantly extended to cover calculation beyond standard DFT, e.g., dispersion-corrected DFT, DFT+U, time-dependent DFTPerfect for graduate students and postdoctoral candidates in physics and engineering, Density Functional Theory: A Practical Introduction will also earn a place in the libraries of researchers and practitioners in chemistry, materials science, and mechanical engineering.; Eine prägnante, gut strukturierte Einführung in die Anwendungen von DFT-BerechnungenIn der neu überarbeiteten zweiten Auflage von Density Functional Theory: A Practical Introduction liefern die Autoren eine prägnante und leicht verständliche Einführung in die wichtigsten Konzepte und praktischen Anwendungen der Dichtefunktionaltheorie (DFT), wobei der Schwerpunkt auf die DFT der ebenen Wellen gelegt wird. Die Autoren, die über jahrzehntelange Erfahrung auf diesem Gebiet verfügen, bieten Studierenden mit unterschiedlichen Vorkenntnissen ein ausgewogenes Maß an Verständlichkeit und Klarheit und haben auf diese Weise ein insgesamt sehr gut zu verstehendes Fachbuch verfasst.\* In dieser neuen Auflage werden die Genauigkeit von DFT-Berechnungen und die Wahl der Funktionale detailliert erörtert\* Das Werk bietet einen Überblick über ein breites Spektrum an verfügbaren DFT-Codes\* Mit zusätzlichen Beispielen zur Nutzung von DFT für Berechnungen von Materialien mit hohem Durchsatz\* Stärkere Hervorhebung der Berechnung von Phasendiagrammen und offener Ensemble-Methoden, die in der Elektrochemie umfassend genutzt werden.\* In dieser erweiterten Auflage werden auch Berechnungen abgedeckt, die über die Standard-DFT hinausgehen, z. B. DFT mit Dispersionskorrektur, DFT+U und zeitabhängige DFT.
- Hardcover
Seller: preigu, Osnabrück, Germanypreigu
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Buch. Condition: Neu. Density Functional Theory | A Practical Introduction | David S. Sholl (u. a.) | Buch | 224 S. | Englisch | 2022 | John Wiley & Sons Inc | EAN 9781119840862 | Verantwortliche Person für die EU: Wiley-VCH GmbH, Boschstr. 12, 69469 Weinheim, product-safety[at]wiley[dot]com | Anbieter: preigu.
- Hardcover
Seller: GoldBooks, Denver, CO, U.S.A.GoldBooks
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- Hardcover
- Print on Demand
Seller: Revaluation Books, Exeter, , United KingdomRevaluation Books
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£ 111.03
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Hardcover. Condition: Brand New. 2nd edition. 204 pages. 10.00x7.00x0.75 inches. In Stock. This item is printed on demand.
