000 | 02965nam a22005175i 4500 | ||
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001 | 978-3-642-25864-0 | ||
003 | DE-He213 | ||
005 | 20160624101900.0 | ||
007 | cr nn 008mamaa | ||
008 | 121213s2013 gw | s |||| 0|eng d | ||
020 |
_a9783642258640 _9978-3-642-25864-0 |
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024 | 7 |
_a10.1007/978-3-642-25864-0 _2doi |
|
050 | 4 | _aQC173.45-173.458 | |
072 | 7 |
_aPHF _2bicssc |
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072 | 7 |
_aSCI077000 _2bisacsh |
|
082 | 0 | 4 |
_a530.41 _223 |
100 | 1 |
_aEyert, Volker. _eauthor. |
|
245 | 1 | 4 |
_aThe Augmented Spherical Wave Method _h[electronic resource] : _bA Comprehensive Treatment / _cby Volker Eyert. |
250 | _a2nd ed. 2013. | ||
260 | 1 |
_aBerlin, Heidelberg : _bSpringer Berlin Heidelberg : _bImprint: Springer, _c2013. |
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264 | 1 |
_aBerlin, Heidelberg : _bSpringer Berlin Heidelberg : _bImprint: Springer, _c2013. |
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300 |
_aXV, 379 p. _bonline resource. |
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336 |
_atext _btxt _2rdacontent |
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337 |
_acomputer _bc _2rdamedia |
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338 |
_aonline resource _bcr _2rdacarrier |
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347 |
_atext file _bPDF _2rda |
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490 | 1 |
_aLecture Notes in Physics, _x0075-8450 ; _v849 |
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505 | 0 | _aIntroduction -- The Standard ASW Method -- Envelope Functions and Structure Constants -- The Plane-Wave Based Full-Potential ASW Method -- The Sperical-Wave Based Full-Potential ASW Method -- Details of the Standard ASW Method -- Details of the Envelope Functions -- Details of the Full-Potential ASW Methods -- Brillouin-Zone Integration -- Further Reading -- Index. | |
520 | _aThe Augmented Spherical Wave (ASW) method is one of the most powerful approaches to handle the requirements of finite basis sets in DFT calculations. It is particularly suited for the calculation of the electronic, magnetic, and optical properties of solid-state materials. Recent developments allow application, in addition, to the elastic properties and phonon spectra. Due to the localized nature of the ASW basis set these properties can be easily interpreted in terms of atomic-like orbitals. The book addresses all those who want to learn about methods for electronic structure calculations and the ASW method in particular. This new edition has been thoroughly revised and extended. In particular, a chapter on the new, both very efficient and accurate spherical-wave based full potential ASW method has been added. | ||
650 | 0 | _aPhysics. | |
650 | 0 | _aChemistry. | |
650 | 0 | _aMaterials. | |
650 | 1 | 4 | _aPhysics. |
650 | 2 | 4 | _aCondensed Matter Physics. |
650 | 2 | 4 | _aNumerical and Computational Physics. |
650 | 2 | 4 | _aTheoretical and Computational Chemistry. |
650 | 2 | 4 | _aMaterials Science, general. |
710 | 2 | _aSpringerLink (Online service) | |
773 | 0 | _tSpringer eBooks | |
776 | 0 | 8 |
_iPrinted edition: _z9783642258633 |
786 | _dSpringer | ||
830 | 0 |
_aLecture Notes in Physics, _x0075-8450 ; _v849 |
|
856 | 4 | 0 | _uhttp://dx.doi.org/10.1007/978-3-642-25864-0 |
942 |
_2EBK2938 _cEBK |
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999 |
_c32232 _d32232 |