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Sökning: WFRF:(Belonoshko Anatoly B.) > High-pressure cryst...

LIBRIS Formathandbok  (Information om MARC21)
FältnamnIndikatorerMetadata
00003023naa a2200481 4500
001oai:DiVA.org:kth-23583
003SwePub
008100810s2004 | |||||||||||000 ||eng|
009oai:DiVA.org:uu-91799
024a https://urn.kb.se/resolve?urn=urn:nbn:se:kth:diva-235832 URI
024a https://doi.org/10.1016/j.jpcs.2003.11.0432 DOI
024a https://urn.kb.se/resolve?urn=urn:nbn:se:uu:diva-917992 URI
040 a (SwePub)kthd (SwePub)uu
041 a engb eng
042 9 SwePub
072 7a ref2 swepub-contenttype
072 7a art2 swepub-publicationtype
100a Belonoshko, Anatoly B.u KTH,Fysik4 aut0 (Swepub:kth)u14jwox1
2451 0a High-pressure crystal structure studies of Fe, Ru and Os
264 1b Elsevier BV,c 2004
338 a print2 rdacarrier
500 a QC 20100525 QC 20110926
520 a In order to reveal structural trends with increasing pressure in d transition metals, we performed full potential linear muffin-tin orbital calculations for Fe, Ru, and Os in the hexagonal close packed structure. The calculations cover a wide volume range and demonstrate that all these hexagonal close-packed metals have non-ideal c/a at low pressures which, however, increases with pressure and asymptotically approaches the ideal value at very high compressions. These results are in accordance with most recent experiment for Ru and Os. The experimental data for iron is not conclusive, but it is believed that the c/a ratio decreases weakly with increasing pressure at moderate compression. Since, the experimental and calculated equations of state for iron are in increasingly good agreement with increasing pressure, it is possible that either the negative c/a trend is valid only for a restricted pressure range, or related to the experimental difficulties (e.g. non-hydrostaticity).
650 7a NATURVETENSKAPx Fysik0 (SwePub)1032 hsv//swe
650 7a NATURAL SCIENCESx Physical Sciences0 (SwePub)1032 hsv//eng
653 a earths inner-core
653 a x-ray-diffraction
653 a in-situ
653 a thermodynamic properties
653 a static compression
653 a phase-transition
653 a iron
653 a temperature
653 a magnesium
653 a simulations
700a Li, S.u Uppsala universitet,Fysiska institutionen,Condensed Matter Theory Group4 aut
700a Ahuja, Rajeevu Uppsala universitet,Fysiska institutionen,Condensed Matter Theory Group4 aut0 (Swepub:uu)rajeeva
700a Johansson, Börjeu Uppsala universitet,KTH,Materialvetenskap,Fysiska institutionen,Condensed Matter Theory Group4 aut0 (Swepub:uu)borjejs
710a KTHb Fysik4 org
773t Journal of Physics and Chemistry of Solidsd : Elsevier BVg 65:09-aug, s. 1565-1571q 65:09-aug<1565-1571x 0022-3697x 1879-2553
8564 8u https://urn.kb.se/resolve?urn=urn:nbn:se:kth:diva-23583
8564 8u https://doi.org/10.1016/j.jpcs.2003.11.043
8564 8u https://urn.kb.se/resolve?urn=urn:nbn:se:uu:diva-91799

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