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- Sandia National LaboratoriesUS256 papers
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5 papers · 1 filter
All-electron GW approximation with the mixed basis expansion based on the full-potential LMTO method
Takao Kotani, Mark van Schilfgaarde
We present a new all-electron, augmented-wave implementation of the GW approximation using eigenfunctions generated by a recent variant of the full-potential LMTO method. The dynam…
Theoretical modeling of prion disease incubation
R. V. Kulkarni, A. Slepoy, R. R. P. Singh +3
We present a theory for the laboratory and epidemiological data for incubation times in infectious prion diseases. The central feature of our model is that slow growth of misfolded…
Nuclear Reactor Safeguards and Monitoring with Antineutrino Detectors
Adam Bernstein, Yifang Wang, Giorgio Gratta +1
Cubic-meter-sized antineutrino detectors can be used to non-intrusively, robustly and automatically monitor and safeguard a wide variety of nuclear reactor types, including power r…
Electronic Structure, Bonding and Optical Spectrum of MgB2
V. P. Antropov, K. D. Belashchenko, M. van Schilfgaarde +1
This paper contains both recently published and original results concerning the electronic structure, bonding and relevant properties of (Mg-Al)B2. We analyse the electronic struct…
Nature of bonding and electronic structure in MgB2, a boron intercalation superconductor
K. D. Belashchenko, M. van Schilfgaarde, V. P. Antropov
Chemical bonding and electronic structure of MgB2, a boron-based newly discovered superconductor, is studied using self-consistent band structure techniques. Analysis of the transf…