Quantum chemical molecular dynamics and kinetic Monte Carlo approach to the design of MgO protecting layer in plasma display panel

Momoji Kubo, Hiromi Kikuchi, Hideyuki Tsuboi, Michihisa Koyama, Akira Endou, Carlos A. Del Carpio, Hiroshi Kajiyama, Akira Miyamoto

Research output: Contribution to journalConference articlepeer-review

Abstract

We developed new quantum chemical molecular dynamics and kinetic Monte Carlo programs to simulate the destruction processes of MgO protecting layer in plasma display panel. Our simulation results proposed that MgO(111) surface with nano-dot structures covered by (001) facets has the highest stability, which is against the previous knowledge. The formation of nano-dot structures on the MgO(111) surface covered by (001) facets was found to be the reason for the high stability of the MgO(111) surface. Furthermore, the effect of grain boundary on the stability of MgO surfaces was also clarified.

Original languageEnglish
Pages (from-to)371-374
Number of pages4
JournalProceedings of International Meeting on Information Display
Volume2006
Publication statusPublished - 2006 Dec 1
EventIMID/IDMC 2006: 6th Internaional Meeting on Information Display and the 5th International Display Manufacturing Conference - Daegu, Korea, Republic of
Duration: 2006 Aug 222006 Aug 25

ASJC Scopus subject areas

  • Engineering(all)

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