Density functional theory molecules (88 résultats)

Hardcover. Etat : Sehr gut. XIV, 182 S.; Ill. Very good. Shrink wrapped. Sprache: Englisch Gewicht in Gramm: 570.

Hardcover. Etat : Fine. No Jacket. First Edition. Near Fine, unmarked book with very minor foxing to half-title; pictorial boards, no DJ.

24 x 16 cm. Etat : Gut. Volume 12. VIII, 320 Seiten ; Mit zahlreichen Figuren und Tabellen Understanding Chemical Reactivity ; Innen sauberer, guter Zustand. Hardcover, Pappeinband, mit den üblichen Bibliotheks-Markierungen, Stempeln und Einträgen, innen wie außen, siehe Bilder. (Evtl. auch Kleber- und/oder Etikettenreste, sowie -abdrücke durch abgelöste Bibliotheksschilder). Einband sehr gut erhalten. In Englisch. B09-02-05F|S91 Sprache: Englisch Gewicht in Gramm: 625. …

Paperback. Etat : New.

Hardcover. Etat : Very Good. Etat de la jaquette : N/A. 1st Edition. xviii, 228pp, with diagrams, charts etc. in text. In laminated card covers. Tall 8vo. Very slightly pushed at spine ends else neat, clean, bright and tight throughout. A collection of papers and essays regarding electron density, density matrices and density functional theory. Hard to find title. …

Etat : As New. Unread book in perfect condition.

Etat : New.

Paperback. Etat : Brand New. 204 pages. 9.25x6.10x0.46 inches. In Stock.

Paperback. Etat : Brand New. 100 pages. 8.66x5.91x0.23 inches. In Stock.

Taschenbuch. Etat : Neu. Druck auf Anfrage Neuware - Printed after ordering - Quantum-mechanical interpretation of density functional theory.- Application of density functional theory to the calculation of force fields and vibrational frequencies of transition metal complexes.- Structure and spectroscopy of small atomic clusters.- Density functional theory of clusters of nontransition metals using simple models.…

Taschenbuch. Etat : Neu. Structure and Reactivity of few Anti-TB Drug Molecules | A Density Functional Theory Approach | Kalyan Kr Hazarika | Taschenbuch | 100 S. | Englisch | 2016 | LAP LAMBERT Academic Publishing | EAN 9783659909795 | Verantwortliche Person für die EU: preigu GmbH & Co. KG, Lengericher Landstr. 19, 49078 Osnabrück, mail[at]preigu[dot]de | Anbieter: preigu. …

Taschenbuch. Etat : Neu. Density Functional Theory of Atoms, Molecules, and Solids | Development of Accurate Semilocal Approximations for Exchange and Correlation | Jianmin Tao | Taschenbuch | Einband - flex.(Paperback) | Englisch | 2010 | VDM Verlag Dr. Müller | EAN 9783639278583 | Verantwortliche Person für die EU: OmniScriptum GmbH & Co. KG, Bahnhofstr. 28, 66111 Saarbrücken, info[at]akademikerverlag[dot]de | Anbieter: preigu.…

Paperback. Etat : New.

Etat : New. 352 pp., Paperback, NEW!! - If you are reading this, this item is actually (physically) in our stock and ready for shipment once ordered. We are not bookjackers. Buyer is responsible for any additional duties, taxes, or fees required by recipient's country. Photos available upon request.

Etat : Gut. Zustand: Gut | Seiten: 332 | Sprache: Englisch | Produktart: Bücher | Rapid advances are taking place in the application of density functional theory (DFT) to describe complex electronic structures, to accurately treat large systems and to predict physical and chemical properties. Both theoretical content and computational methodology are developing at a pace which offers researchers new opportunities in areas such as quantum chemistry, cluster science, and solid state physics. This volume contains ten contributions by leading scientists in the field and provides an authoritative overview of the most important developments. The book focuses on the following themes: determining adequate approximations for the many-body problem of electronic correlations; how to transform these approximations into computational algorithms; applications to discover and predict properties of electronic systems; and developing the theory. For researchers in surface chemistry, catalysis, ceramics and inorganic chemistry.…

Etat : good. A copy that has been read, remains in good condition. All pages are intact, and the cover is intact. The spine and cover show signs of wear. Pages can include notes and highlighting and show signs of wear, and the copy can include "From the library of" labels or previous owner inscriptions. 100% GUARANTEE! Shipped with delivery confirmation, if you're not satisfied with purchase please return item! Ships via media mail.…

Etat : Fair. Volume 16. This is an ex-library book and may have the usual library/used-book markings inside.This book has soft covers. In fair condition, suitable as a study copy. Please note the Image in this listing is a stock photo and may not match the covers of the actual item,700grams, ISBN:9780195092769. …

Etat : Brand New. New. US edition. Expediting shipping for all USA and Europe orders excluding PO Box. Excellent Customer Service.

Etat : New.

Etat : 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.

Paperback. Etat : Like New. LIKE NEW. SHIPS FROM MULTIPLE LOCATIONS. book.

Etat : As New. Unread book in perfect condition.

Buch. Etat : Neu. Druck auf Anfrage Neuware - Printed after ordering - Rapid advances are taking place in the application of density functional theory (DFT) to describe complex electronic structures, to accurately treat large systems and to predict physical and chemical properties. Both theoretical content and computational methodology are developing at a pace which offers researchers new opportunities in areas such as quantum chemistry, cluster science, and solid state physics. This volume contains ten contributions by leading scientists in the field and provides an authoritative overview of the most important developments. The book focuses on the following themes: determining adequate approximations for the many-body problem of electronic correlations; how to transform these approximations into computational algorithms; applications to discover and predict properties of electronic systems; and developing the theory. For researchers in surface chemistry, catalysis, ceramics and inorganic chemistry.…

Taschenbuch. Etat : Neu. Druck auf Anfrage Neuware - Printed after ordering - Rapid advances are taking place in the application of density functional theory (DFT) to describe complex electronic structures, to accurately treat large systems and to predict physical and chemical properties. Both theoretical content and computational methodology are developing at a pace which offers researchers new opportunities in areas such as quantum chemistry, cluster science, and solid state physics. This volume contains ten contributions by leading scientists in the field and provides an authoritative overview of the most important developments. The book focuses on the following themes: determining adequate approximations for the many-body problem of electronic correlations; how to transform these approximations into computational algorithms; applications to discover and predict properties of electronic systems; and developing the theory. For researchers in surface chemistry, catalysis, ceramics and inorganic chemistry.…

Hardcover. Etat : gut. 1994. Density Functional Theory of Molecules, Clusters, and Solids In englischer Sprache. pages.

Etat : New. pp. vii + 320.

Etat : New.

Etat : New.

Etat : New.

Etat : As New. Unread book in perfect condition.