Anomalous effective charges and far-IR optical absorption of Al2Ru from first principles.
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Biomedical subjects
KM Rabe
Publications and source records attributed to KM Rabe.
Localized basis for effective lattice Hamiltonians: Lattice Wannier functions.
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Polymorphism and metastability in NbN: Structural predictions from first principles.
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First-principles theory of ferroelectric phase transitions for perovskites: The case of BaTiO3.
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Band gap and stability in the ternary intermetallic compounds NiSnM (M=Ti,Zr,Hf): A first-principles study.
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Phase transitions in BaTiO3 from first principles.
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Ab initio pseudopotential calculations for aluminum-rich cobalt compounds.
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Structures and phases of superconducting alkali-metal doped C60.
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Novel A15 phase in barium-doped fullerite.
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Global multinary structural chemistry of stable quasicrystals, high-TC ferroelectrics, and high-Tc superconductors.
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Erratum: Optimized pseudopotentials
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Anomalous properties and microstructural model of superconductivity in La2-x(Ba,Sr)xCuO4.
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Quantum diagrams and the prediction of new ternary quasicrystals.
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Transport anomalies and internal structural models of stable quasicrystals.
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Optimized pseudopotentials.
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Superconductivity and lattice distortions in high-Tc superconductors.
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Theory of the structural phase transition of GeTe.
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Structural properties of GeTe at T=0.
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