First-principles investigation of B-site ordering in Ba(MgxTa1-x)O3 microwave dielectrics with the complex perovskite structure

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[1] [1,Takahashi, Takeshi
[2] Wu, Eric J.
[3] Van Der Ven, Anton
[4] Ceder, Gerbrand
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Takahashi, Takeshi | 2000年 / JJAP, Tokyo, Japan卷 / 39期
关键词：
Barium compounds - Computer simulation - Electronic density of states - Ground state - High temperature effects - Low temperature operations - Molecular structure - Monte Carlo methods - Numerical methods - Order disorder transitions - Positive ions;
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