000 01531nam a2200313 a 4500
001 EDZ0000095422
003 StDuBDS
005 20150804193933.0
006 m||||||||d||||||||
007 cr||||||||||||
008 120822s2012 enka fo| 001 0 eng|d
020 _a9780191740992 (ebook) :
_cNo price
040 _aStDuBDS
_cStDuBDS
050 4 _aQC173.4.A87
_bC4 2012
082 0 4 _a539.14
_223
100 1 _aChing, Wai-Yim.
245 1 0 _aElectronic structure methods for complex materials
_h[electronic resource] :
_bthe orthogonalized linear combination of atomic orbitals /
_cWai-Yim Ching and Paul Rulis.
260 _aOxford :
_bOxford University Press,
_c2012.
300 _a1 online resource (xiii, 310 p.) :
_bill.
520 8 _aThis 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.
588 _aDescription based on online resource; title from PDF title page (viewed on Aug. 24, 2012).
504 _aIncludes bibliographical references and index.
650 0 _aAtomic orbitals.
650 0 _aElectronic structure.
650 0 _aDensity functionals.
700 1 _aRulis, Paul Michael,
_d1976-
776 0 8 _iPrint version
_z9780199575800
856 4 0 _3Oxford scholarship online
_uhttp://dx.doi.org/10.1093/acprof:oso/9780199575800.001.0001
999 _c37476
_d37476