Title of article
Ab initio predictions of ferroelectric ternary fluorides with the LiNbO3 structure
Author/Authors
Claeyssens، Frederik نويسنده , , Oliva، Josep M. نويسنده , , Snchez-Portal، Daniel نويسنده , , Allan، Neil L. نويسنده ,
Issue Information
روزنامه با شماره پیاپی سال 2003
Pages
-243
From page
244
To page
0
Abstract
First-principles periodic density-functional theory calculations suggest ternary fluorides LiMgF3, NaCaF3 and LiNiF3 should adopt the ferroelectric LiNbO3 structure at low temperatures; LiMgF3 and LiNiF3 are predicted to have negative enthalpies of formation from the binary fluorides
Keywords
evolution galaxies , starburstinfrared
Journal title
CHEMICAL COMMUNICATIONS - LETCHWORTH
Serial Year
2003
Journal title
CHEMICAL COMMUNICATIONS - LETCHWORTH
Record number
68539
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