Electronic structure methods for complex materials [electronic resource] : the orthogonalized linear combination of atomic orbitals /
by Ching, Wai-Yim; Rulis, Paul Michael.
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BookPublisher: Oxford : Oxford University Press, 2012Description: 1 online resource (xiii, 310 p.) : ill.ISBN: 9780191740992 (ebook) :.Subject(s): Atomic orbitals | Electronic structure | Density functionalsOnline resources: Oxford scholarship online Summary: This title details the application of the OLCAO method for calculating the properties of solids from fundamental principles to a wide array of material systems. The method specialises in large and complex models and is able to compute a variety of useful properties including electronic, optical, and spectroscopic properties.
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This title details the application of the OLCAO method for calculating the properties of solids from fundamental principles to a wide array of material systems. The method specialises in large and complex models and is able to compute a variety of useful properties including electronic, optical, and spectroscopic properties.
Description based on online resource; title from PDF title page (viewed on Aug. 24, 2012).
Includes bibliographical references and index.
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