Native defects in LiTaO3 photocatalyst : a DFT study

Native defects in LiTaO3 photocatalyst : a DFT study

First principle calculations based on density-functional theory were conducted to investigate the formation energies of various native defects in lithium tantalate, LiTaO3, a prospective photo catalyst for the splitting of water. The formation of various defects is found to be sensitive to the growt...

書誌詳細
第一著者:	Loke, Yin Yin.
その他の著者:	Su Haibin
フォーマット:	Final Year Project (FYP)
言語:	English
出版事項:	2010
主題:	DRNTU::Engineering::Materials
オンライン･アクセス:	http://hdl.handle.net/10356/36176

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