高温高压下zno物理性质的第一性原理计算-原子与分子物理专业论文.docxVIP

摘要 摘要 agaFW agaFW 关键词z 第一性原理 相变 热力学性质 弹性常数 4 n Ab Abs阳ct 111 111 Abstract ZnO is a v町satile oxide semiconductor mat町ia1. It has a伽acted incre即ing int田est in recent ye町s because of its superior electronic，optica1， and piezoel创衍ic prop町6饵， 1mdmgωa wide range of applications such 础 light-emitting diodes，transp町ent field咱ffect transisω囚， u1traviolet nanolasers， ωl配 ω:l1 and photovoltaics. Many of ZnO 也in film technology ∞mpatible wi伽 阳.tegrated circuit manufacturing proωss，ωit is able to chieve integration with siliωn and 0也町 semi∞nductor deviωs. In short