Search Results - "HAIRIE, A"
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An empirical potential for the calculation of the atomic structure of extended defects in wurtzite GaN
Published in Computational materials science (01-06-2000)“…The Stillinger–Weber potential has been parametrized for GaN with bond-type dependent parameters to allow efficient atomic simulations of large systems…”
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Journal Article Conference Proceeding -
2
Basal stacking faults and (10 2) twin energies by a semi-empirical tight-binding method for zinc and cadmium
Published in Physica Status Solidi (b) (01-09-2004)“…The study of extended defects requires atomic modelisation able to give theoretical values characterizing the defects to be compared to experimental…”
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3
Energy of the Two Variants 11A and 11B in Silicon and Germanium by the Semi-Empirical Tight-Binding Method
Published in Physica status solidi. B. Basic research (01-08-2002)“…A semi‐empirical tight‐binding model was used to study the total energy of Σ = 11 tilt grain boundaries in silicon and germanium. At low temperature the…”
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4
Analysis of Distortions in 〈110〉 Tilt Silicon Bicrystals
Published in physica status solidi (b) (01-08-2000)“…The empirical potentials used for defect simulation in silicon are fitted on elastic or phonon properties. Usually they are not able to take into account all…”
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Analysis of distortions in tilt silicon bicrystals
Published in Physica status solidi. B. Basic research (2000)Get full text
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Determination of the high c/a ratio of hexagonal metals with a semi-empirical tight-binding method
Published in Computational materials science (01-06-2000)“…A semi-empirical tight-binding potential is developed to reproduce the high c/a ratio of zinc and cadmium. In this scheme, we show that the calculation of the…”
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7
Carbon and germanium distributions in Si1−x−yGexCy layers epitaxially grown on Si(001) by RTCVD
Published in Thin solid films (15-02-1997)Get full text
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8
The volume expansion of the {112̄0} planar defect in 2H–GaN/6H–SiC (0001) Si grown by MBE
Published in Thin solid films (29-04-1998)“…In an attempt to complete the determination of the atomic structure of the {112̄0} planar defects which are found systematically in the interfacial area of…”
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9
Comparison of two O(N) methods for total-energy semi-empirical tight-binding calculation
Published in Computational materials science (01-02-1998)“…We compare two O(N) methods, to calculate the total energy of a system, based on a local evaluation of the density matrix (DM) via the Lanczos-Haydock…”
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10
Potential energy of two structures of Σ = 11〈0 1 1〉 tilt grain boundary in silicon and germanium with empirical potentials and tight-binding methods
Published in Computational materials science (01-02-1998)“…Two atomic structures A and B of the Σ = 11〈0 1 1〉 grain boundary were observed in silicon and germanium. We have performed a complete study of the stability…”
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11
Free energies of interfaces from quasi-harmonic theory: A critical appraisal
Published in Interface science (01-01-1994)“…A critical assessment is given of the quasi-harmonic approximation, and various approximations to the quasi-harmonic approximation, with regard to predicting…”
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12
Analysis and capacitive measurement of the built-in-field parameter in highly doped emitters
Published in IEEE transactions on electron devices (01-01-1982)“…An elementary theory of a strongly asymmetric n + -n-p junction, assuming an exponential tail of the donor concentration profile in the depletion layer, is…”
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13
Methods of minimizing free energies directly
Published in Journal of phase equilibria (01-12-1997)“…Standard simulation techniques can be found in the literature to evaluate free energies of materials by thermodynamic integration. These technqieus, though…”
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14
Magnetization of a type-I superconducting slab in the thermodynamic and the metastable phases
Published in Physical review. B, Condensed matter (01-06-1980)Get full text
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15
Determination of the high c/a ratio of hexagonal metals with a semi-empirical tight-binding method
Published in Computational materials science (01-06-1999)“…A semi-empirical tight-binding potential is developed to reproduce the high c/a ratio of zinc and cadmium. In this scheme, we show that the calculation of the…”
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16
Reversible stage of the magnetization and migration field of pure lead superconducting slabs
Published in Physical review. B, Condensed matter (01-04-1980)“…Measurements of the magnetic moment of pure Pb superconducting slabs in the first reversible stage and of the migration field are given and compared with…”
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17
Carbon and germanium distributions in Si 1− x− yGe xC y layers epitaxially grown on Si(001) by RTCVD
Published in Thin solid films (1997)“…Silicon germanium carbon with up to 1.5% of substitutional carbon can be grown epitaxially on Si(001) by rapid thermal chemical vapor deposition (RTCVD) using…”
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18
The volume expansion of the 1120 planar defect in 2H-GaN/6H-SiC (0001)Si grown by MBE
Published in Thin solid films (1998)Get full text
Conference Proceeding -
19
Optical correlator using the incoherent light of a slide projector
Published in American journal of physics (01-09-1983)“…The simple apparatus based on geometrical optics described here allows both qualitative and quantitative verification of the main properties of convolution,…”
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Neutronic optimization of thorium-based fuel configurations for minimizing slightly used nuclear fuel and radiotoxicity in small modular reactors
Published in Nuclear engineering and technology (2024)“…Effective management of slightly used nuclear fuel (SUNF) is crucial for both technical and public acceptance reasons. SUNF management, radiotoxicity risk, and…”
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