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| 009 | 182395057 | ||
| 003 | http://www.sudoc.fr/182395057 | ||
| 005 | 20250630092607.0 | ||
| 010 |
_a9780199662432 _brel. |
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| 010 | _a0-19-966243-6 | ||
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_a978-0-19-966244-9 _bbr. |
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| 100 | _a20141211h20142014k y0frey50 ba | ||
| 101 | 0 |
_aeng _2639-2 |
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| 106 | _ar | ||
| 181 |
_6z01 _ctxt _2rdacontent |
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| 181 | 1 |
_6z01 _ai# _bxxxe## |
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| 182 |
_6z01 _cn _2rdamedia |
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| 182 | 1 |
_6z01 _an |
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| 200 | 1 |
_aMaterials modelling using density functional theory _eproperties and predictions _fFeliciano Giustino |
|
| 210 |
_aOxford _cOxford University Press _dcop. 2014 |
||
| 215 |
_a1 vol. (xiv-286 p.) _cill. _d24 cm |
||
| 320 | _aBibliogr. p. 264-283. Index | ||
| 359 | 2 |
_b1, Notation _b2, Many-body Schrödinger equation _b3, Density functional theory _b4, Equilibrium structures of materials : fundamentals _b5, Equilibrium structures of materials : calculation svs. experiment _b6, Elastic properties of materials _b7, Vibrations of molecules and solids _b8, Phonons, vibrational spectroscopy and thermodynamics _b9, Band structures and photoelectron spectroscopy _b10, Dielectric function and optical spectra _b11, Density functional theory and magnetic materials |
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| 606 |
_aMaterials _xMathematical models _2lc |
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| 606 |
_aDensity functionals _2lc |
||
| 606 |
_3027282457 _aMatériaux _3027551385 _xModèles mathématiques _2rameau |
||
| 606 |
_303142628X _aThéorie de la fonctionnelle de densité _2rameau |
||
| 676 | _a620.1 | ||
| 680 |
_aTA403.6 _b.G58 2014 |
||
| 700 | 1 |
_3182394948 _aGiustino _bFeliciano _f19..-.... _4070 |
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