Structural transformations of Li2C2 at high pressures

Autor: Efthimiopoulos, Ilias, Benson, Daryn E., Konar, Sumit, Nylen, Johanna, Svensson, Gunnar, Haussermann, Ulrich, Liebig, Stefan, Ruschewitz, Uwe, Vazhenin, Grigory V., Loa, Ingo, Hanfland, Michael, Syassen, Karl

Structural changes of Li2C2 under pressure were studied by synchrotron x-ray diffraction in a diamond anvil cell under hydrostatic conditions and by using evolutionary search methodology for crystal structure prediction. We show that the high-pressur

Externí odkaz: http://arxiv.org/abs/1604.07715

No experimental Fermi surface measurements have been reported or made on low-temperature martensitic lithium

Autor: Martinez-Canales, Miguel, Loa, Ingo, Ackland, Graeme J.

Publikováno v: Proceedings of the National Academy of Sciences of the United States of America, 2017 Oct . 114(42), E8809-E8809.

Externí odkaz: https://www.jstor.org/stable/26488955

Interplay of metallic and ionic bonding in layered subnitrides AE2N ( AE = Ca, Sr, or Ba) under high pressure

Autor: Vajenine, Grigori V. ^*, Grzechnik, Andrzej, Syassen, Karl, Loa, Ingo, Hanfland, Michael, Simon, Arndt

Publikováno v: In Comptes rendus - Chimie 2005 8(11):1897-1905

High-pressure phases of lithia Li2O: First-principles calculations

Autor: Loa, Ingo, Kunc, Karel, Syassen, Karl

Publikováno v: Physical Review B: Condensed Matter and Materials Physics (1998-2015)
Physical Review B: Condensed Matter and Materials Physics (1998-2015), 2008, 77, pp.094110. ⟨10.1103/PhysRevB.77.094110⟩
Physical Review B: Condensed Matter and Materials Physics (1998-2015), American Physical Society, 2008, 77, pp.094110. ⟨10.1103/PhysRevB.77.094110⟩
Loa, I, Kunc, K & Syassen, K 2008, ' High-pressure phases of lithia Li2O: First-principles calculations ', Physical review B: Condensed matter and materials physics, vol. 77, no. 9, 094110 . https://doi.org/10.1103/PhysRevB.77.094110

International audience; The high-pressure HP structural properties of Li2O are examined theoretically using first-principles calculations density-functional theory . The calculated results for the HP anticotunnite modification are compared to recent

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=dedup_wf_001::18b8529ed4b585004ca614b9f4333237
https://hal.science/hal-00793387

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