| 000 | 01163cam a22002177i 4500 | ||
|---|---|---|---|
| 999 |
_c20182 _d20182 |
||
| 001 | 17918195 | ||
| 005 | 20210716161010.0 | ||
| 008 | 131025s2014 enka b 001 0 eng d | ||
| 020 | _a9780199662432 (hbk) | ||
| 040 | _cUE-CL | ||
| 082 |
_a620.11 _bG4493 |
||
| 100 | 1 | _aGiustino, Feliciano. | |
| 245 | 1 | 0 |
_aMaterials modelling using density functional theory : _bproperties and predictions / _cFeliciano Giustino. |
| 250 | _a1st ed. | ||
| 260 |
_aOxford : _bOxford University Press, _c2014 |
||
| 300 |
_axiv, 286 p. : _billustration ; _c25 cm |
||
| 650 | 0 |
_aMaterials _xMathematical models. |
|
| 650 | 0 | _aDensity functionals. | |
| 942 | _cBK | ||
| 505 | 0 | _acomputational materials modelling from first principles; many-body Schrodinger equation; density functional theory; equilibrium structures of materials: fundamentals; equilibrium structures of materials: calculation vs. experiment; elastic properties of materials; vibrations of molecules and solids; phonons, vibrational spectroscopy and thermodynamics; band structures and photoelectron spectroscopy; dielectric function and optical spectra; density functional theory and magnetic materials | |