High Pressure Phases of N-rich NxO Compoundsby Random Structure Search

碩士 === 國立臺灣大學 === 物理學研究所 === 106 === We perform the random structure search for N2/O2 binary system under high pressure within the framework of density functional theory. We have found five types of structures to be energetically competitive under different circumstances. Including molecular, polyme...

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Bibliographic Details
Main Authors: Hao-Chien Hung, 洪豪謙
Other Authors: 王玉麟
Format: Others
Language:en_US
Published: 2018
Online Access:http://ndltd.ncl.edu.tw/handle/q5394k