Oxygen K-edge electron energy loss spectra of hydrous and anhydrous compounds.

First-principles calculations have been employed to examine the possible use of electron energy loss spectroscopy (EELS) as a tool for determining the presence of OH groups and hence hydrogen content in compounds. Our density functional theory (DFT) based calculations describe accurately the experim...

詳細記述

書誌詳細
主要な著者: Winkler, B, Avalos-Borja, M, Milman, V, Perlov, A, Pickard, C, Yates, JR
フォーマット: Journal article
言語:English
出版事項: 2013