Integrated computational chemistry system for the material design of plasma display panel

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

Research output: Contribution to conferencePaperpeer-review

5 Citations (Scopus)

Abstract

First-principles calculations suggested that both positive and negative charges accumulated in MgO protecting layer decrease its stability. Moreover, we proposed that Al cation is an effective dopant for the MgO protecting layer, because it increases both the stability and secondary electron emitting ability. Our tight-binding quantum chemical molecular dynamics method revealed that oxygen vacancy decreases the stability of the MgO protecting layer. Finally, we concluded that our integrated computational chemistry system is very effective to design plasma display panel.

Original languageEnglish
Pages423-426
Number of pages4
Publication statusPublished - 2005 Dec 1
EventIDW/AD'05 - 12th International Display Workshops in Conjunction with Asia Display 2005 - Takamatsu, Japan
Duration: 2005 Dec 62005 Dec 9

Other

OtherIDW/AD'05 - 12th International Display Workshops in Conjunction with Asia Display 2005
CountryJapan
CityTakamatsu
Period05/12/605/12/9

ASJC Scopus subject areas

  • Engineering(all)

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