Sökning: WFRF:(Belonoshko Anatoly B.) > High-pressure cryst...
Fältnamn | Indikatorer | Metadata |
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000 | 03023naa a2200481 4500 | |
001 | oai:DiVA.org:kth-23583 | |
003 | SwePub | |
008 | 100810s2004 | |||||||||||000 ||eng| | |
009 | oai:DiVA.org:uu-91799 | |
024 | 7 | a https://urn.kb.se/resolve?urn=urn:nbn:se:kth:diva-235832 URI |
024 | 7 | a https://doi.org/10.1016/j.jpcs.2003.11.0432 DOI |
024 | 7 | a 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 | 7 | a ref2 swepub-contenttype |
072 | 7 | a art2 swepub-publicationtype |
100 | 1 | a Belonoshko, Anatoly B.u KTH,Fysik4 aut0 (Swepub:kth)u14jwox1 |
245 | 1 0 | a High-pressure crystal structure studies of Fe, Ru and Os |
264 | 1 | b 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 | 7 | a NATURVETENSKAPx Fysik0 (SwePub)1032 hsv//swe |
650 | 7 | a 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 | |
700 | 1 | a Li, S.u Uppsala universitet,Fysiska institutionen,Condensed Matter Theory Group4 aut |
700 | 1 | a Ahuja, Rajeevu Uppsala universitet,Fysiska institutionen,Condensed Matter Theory Group4 aut0 (Swepub:uu)rajeeva |
700 | 1 | a Johansson, Börjeu Uppsala universitet,KTH,Materialvetenskap,Fysiska institutionen,Condensed Matter Theory Group4 aut0 (Swepub:uu)borjejs |
710 | 2 | a KTHb Fysik4 org |
773 | 0 | t Journal of Physics and Chemistry of Solidsd : Elsevier BVg 65:09-aug, s. 1565-1571q 65:09-aug<1565-1571x 0022-3697x 1879-2553 |
856 | 4 8 | u https://urn.kb.se/resolve?urn=urn:nbn:se:kth:diva-23583 |
856 | 4 8 | u https://doi.org/10.1016/j.jpcs.2003.11.043 |
856 | 4 8 | u https://urn.kb.se/resolve?urn=urn:nbn:se:uu:diva-91799 |
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