Search Results - "KJEKSHUS, A"

Growth of Fe2O3 thin films by atomic layer deposition by LIE, M, FJELLVAG, H, KJEKSHUS, A

“…Thin films of D*a-Fe2O3 (D*a-Al2O3-type crystal structure) and D*g-Fe2O3 (defect-spinel-type crystal structure) have been grown by the atomic layer deposition…”
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Electronic structure and chemical bonding in half-Heusler phases by Offernes, Laila, Ravindran, P., Kjekshus, A.

“…The electronic structure and chemical bonding in half-Heusler phases have been systematically investigated using first-principles, self-consistent…”
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Structural stability of alkali boron tetrahydrides ABH4 (A = Li, Na, K, Rb, Cs) from first principle calculation by VAJEESTON, P, RAVINDRAN, P, KJEKSHUS, A, FJELLVAG, H

“…The light elements of groups I-III, e.g. Li, Be, Na, Mg, B, and Al, forma a large variety of complex hydrides with are interesting from a storage point of view…”
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Growth of manganese oxide thin films by atomic layer deposition by Nilsen, O., Fjellvåg, H., Kjekshus, A.

“…Thin films of manganese oxide are made by the ALD (atomic layer deposition) technique using Mn(thd) 3 (Hthd=2,2,6,6-tetramethylheptan-3,5-dione) and ozone as…”
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Pressure-induced structural transitions in MgH2 by Vajeeston, P, Ravindran, P, Kjekshus, A, Fjellvåg, H

“…The stability of MgH2 has been studied up to 20 GPa using density-functional total-energy calculations. At ambient pressure alpha-MgH2 takes a TiO2-rutile-type…”
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Pressure-induced phase of NaAlH4: A potential candidate for hydrogen storage? by Vajeeston, P., Ravindran, P., Vidya, R., Fjellvåg, H., Kjekshus, A.

“…The electronic structure and structural stability of the technologically interesting material NaAlH4 are studied using an ab initio projected augmented…”
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First-principles investigations of the MMgH3 (M = Li, Na, K, Rb, Cs) series by VAJEESTON, P, RAVINDRAN, P, KJEKSHUS, A, FJELLVAG, H

“…The structural stability of the MMgH3 (M=Li, Na, K, Rb, Cs) series has been investigated using the density-functional projector-augmented-wave method within…”
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Effect of substrate on the characteristics of manganese(IV) oxide thin films prepared by atomic layer deposition by Nilsen, O., Foss, S., Fjellvåg, H., Kjekshus, A.

“…Manganese(IV) oxide exhibits many different crystal structures, and growth of thin films of this compound is expected to experience a guiding effect from the…”
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Structural stability of BeH2 at high pressures by Vajeeston, P., Ravindran, P., Kjekshus, A., Fjellvåg, H.

“…The electronic structure and structural stability of BeH2 are studied using first-principles density-functional calculation. The calculated structural…”
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Growth of calcium carbonate by the atomic layer chemical vapour deposition technique by Nilsen, O., Fjellvåg, H., Kjekshus, A.

“…Thin films of CaCO 3 (calcite) have been grown with the atomic layer chemical vapour deposition (ALCVD) technique, using Ca(thd) 2…”
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Nanocrystalline Orthoferrite GdFeO3 from a Novel Heterobimetallic Precursor by Mathur, S., Shen, H., Lecerf, N., Kjekshus, A., Fjellvåg, H., Goya, G.F.

“…A single‐step hydrolytic decomposition of a mixed‐metal precursor (see Figure) results in the size‐controlled synthesis of nanocrystalline GdFeO3 particles…”
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Crystal structure of KAlH4 from first principle calculations by VAJEESTON, P, RAVINDRAN, P, KJEKSHUS, A, FJELLVAG, H

“…The crystal structure of KAlH4 is determined by the first principle projected augmented plane wave method taking different possible structural arrangements…”
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Prediction of composition for stable half-Heusler phases from electronic-band-structure analyses by Offernes, L., Ravindran, P., Seim, C.W., Kjekshus, A.

“…This report describes a procedure to predict the frequently occurring non-stoichiometry of the half-Heusler XYZ alloys (viz. deviations from the equiatomic…”
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Structure and bonding in BAlH5 (, Ca, Sr) from first-principle calculations by Klaveness, A., Vajeeston, P., Ravindran, P., Fjellvåg, H., Kjekshus, A.

“…Prediction of structures for the hitherto hypothetical compounds BeAlH5, CaAlH5, and SrAlH5 have been attained through minimization of the total energy for 50…”
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Effect of magnetic field on the growth of α-Fe2O3 thin films by atomic layer deposition by Nilsen, O., Lie, M., Foss, S., Fjellvåg, H., Kjekshus, A.

“…Effect of magnetic field on the growth of α-Fe2O3 thin films on soda–lime–glass and α-Al2O3(001) substrates with the atomic layer deposition (ALD) technique is…”
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Modeling of hydrogen storage materials by density-functional calculations by Ravindran, P., Vajeeston, P., Vidya, R., Fjellvåg, H., Kjekshus, A.

“…Theoretical investigations on the electronic structure, chemical bonding, and ground-state and high pressure properties of metal and complex hydrides are…”
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Electronic Structure and Excited-state Properties of Perovskite-like Oxides by Ravindran, P, Vidya, R, Fjellvåg, H, Kjekshus, A

“…The role of structural distortion, magnetic ordering, and Coulomb-correlation effect on the electronic structure of perovskite-like oxides is analyzed. The…”
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Huge magneto-optical effects in half-metallic double perovskites by VIDYA, R, RAVINDRAN, P, KJEKSHUS, A, FJELLVAG, H

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A semi-empirical approach to accurate standard enthalpies of formation for solid hydrides by Klaveness, A., Fjellvåg, H., Kjekshus, A., Ravindran, P., Swang, O.

“…A semi-empirical method for estimation of enthalpies of formation of solid hydrides is proposed. The method is named Ionic for short. By combining…”
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Violation of the minimum h-h separation "Rule" for metal hydrides by Ravindran, P, Vajeeston, P, Vidya, R, Kjekshus, A, Fjellvåg, H

“…Using gradient-corrected, full-potential, density-functional calculations, including structural relaxations, it is found that the metal hydrides RTInH1.333…”
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