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liubainian
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3Â¥2008-09-26 08:37:33
yan_lee
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You can use the phonon dispersion curves and the elctronic energy from DFT to anylze all the thermodynamical properties. You can also use it to study the structural stability of the crystals and predict new phases. In addition, Raman and IR frequencies, sound velocity and elastic properties can also be obtained. |
2Â¥2008-09-25 18:04:53
yan_lee
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4Â¥2008-09-26 22:01:31













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