{"id":"https://openalex.org/W4311130413","doi":"https://doi.org/10.1515/zkri-2022-0051","title":"A novel crystallographic location of rattling atoms in filled Eu x Co4Sb12 skutterudites prepared under high-pressure conditions","display_name":"A novel crystallographic location of rattling atoms in filled Eu x Co4Sb12 skutterudites prepared under high-pressure conditions","publication_year":2022,"publication_date":"2022-12-12","ids":{"openalex":"https://openalex.org/W4311130413","doi":"https://doi.org/10.1515/zkri-2022-0051"},"language":"en","primary_location":{"id":"doi:10.1515/zkri-2022-0051","doi":"https://doi.org/10.1515/zkri-2022-0051","is_oa":true,"landing_page_url":"https://doi.org/10.1515/zkri-2022-0051","pdf_url":null,"source":{"id":"https://openalex.org/S4210205906","display_name":"Zeitschrift f\u00fcr Kristallographie - Crystalline Materials","issn_l":"2194-4946","issn":["2194-4946","2196-7105"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-c","jufo-1","poland-70","russia-white-list-2"],"host_organization":"https://openalex.org/P4310313990","host_organization_name":"De Gruyter","host_organization_lineage":["https://openalex.org/P4310313990"],"host_organization_lineage_names":["De Gruyter"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Zeitschrift f\u00fcr Kristallographie - Crystalline Materials","raw_type":"journal-article"},"volume":null,"type":"article","is_traditional":true,"indexed_in":["crossref"],"open_access":{"is_oa":true,"oa_status":"hybrid","oa_url":"https://doi.org/10.1515/zkri-2022-0051","any_repository_has_fulltext":false},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5078422937","display_name":"Jo\u00e3o Elias F. S. Rodrigues","orcid":"https://orcid.org/0000-0002-9220-5809","observed_orcids":["https://orcid.org/0000-0002-9220-5809"]},"institutions":[{"id":"https://openalex.org/I134820265","display_name":"Consejo Superior de Investigaciones Cient\u00edficas","ror":"https://ror.org/02gfc7t72","country_code":"ES","type":"government","lineage":["https://openalex.org/I134820265"]},{"id":"https://openalex.org/I2801997478","display_name":"European Synchrotron Radiation Facility","ror":"https://ror.org/02550n020","country_code":"FR","type":"facility","lineage":["https://openalex.org/I2801997478"]},{"id":"https://openalex.org/I4210118429","display_name":"Instituto de Ciencia de Materiales de Madrid","ror":"https://ror.org/02qqy8j09","country_code":"ES","type":"facility","lineage":["https://openalex.org/I134820265","https://openalex.org/I4210118429"]}],"countries":["ES","FR"],"is_corresponding":false,"raw_author_name":"Jo\u00e3o Elias F. S. Rodrigues","raw_affiliation_strings":["European Synchrotron Radiation Facility (ESRF) , 71 Avenue des Martyrs, 38000 Grenoble , France","Instituto de Ciencia de Materiales de Madrid (ICMM), Consejo Superior de Investigaciones Cient\u00edficas (CSIC) , Sor Juana In\u00e9s de la Cruz 3, E-28049 , Madrid , Spain"],"raw_orcid":"https://orcid.org/0000-0002-9220-5809","affiliations":[{"raw_affiliation_string":"European Synchrotron Radiation Facility (ESRF) , 71 Avenue des Martyrs, 38000 Grenoble , France","institution_ids":["https://openalex.org/I2801997478"]},{"raw_affiliation_string":"Instituto de Ciencia de Materiales de Madrid (ICMM), Consejo Superior de Investigaciones Cient\u00edficas (CSIC) , Sor Juana In\u00e9s de la Cruz 3, E-28049 , Madrid , Spain","institution_ids":["https://openalex.org/I134820265","https://openalex.org/I4210118429"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5063418022","display_name":"Javier Gainza","orcid":"https://orcid.org/0000-0002-1999-3116","observed_orcids":["https://orcid.org/0000-0002-1999-3116"]},"institutions":[{"id":"https://openalex.org/I134820265","display_name":"Consejo Superior de Investigaciones Cient\u00edficas","ror":"https://ror.org/02gfc7t72","country_code":"ES","type":"government","lineage":["https://openalex.org/I134820265"]},{"id":"https://openalex.org/I4210118429","display_name":"Instituto de Ciencia de Materiales de Madrid","ror":"https://ror.org/02qqy8j09","country_code":"ES","type":"facility","lineage":["https://openalex.org/I134820265","https://openalex.org/I4210118429"]}],"countries":["ES"],"is_corresponding":false,"raw_author_name":"Javier Gainza","raw_affiliation_strings":["Instituto de Ciencia de Materiales de Madrid (ICMM), Consejo Superior de Investigaciones Cient\u00edficas (CSIC) , Sor Juana In\u00e9s de la Cruz 3, E-28049 , Madrid , Spain"],"raw_orcid":"https://orcid.org/0000-0002-1999-3116","affiliations":[{"raw_affiliation_string":"Instituto de Ciencia de Materiales de Madrid (ICMM), Consejo Superior de Investigaciones Cient\u00edficas (CSIC) , Sor Juana In\u00e9s de la Cruz 3, E-28049 , Madrid , Spain","institution_ids":["https://openalex.org/I134820265","https://openalex.org/I4210118429"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5025883337","display_name":"Federico M. Serrano-Sanchez","orcid":"https://orcid.org/0000-0002-6882-225X","observed_orcids":["https://orcid.org/0000-0002-6882-225X"]},"institutions":[{"id":"https://openalex.org/I134820265","display_name":"Consejo Superior de Investigaciones Cient\u00edficas","ror":"https://ror.org/02gfc7t72","country_code":"ES","type":"government","lineage":["https://openalex.org/I134820265"]},{"id":"https://openalex.org/I4210118429","display_name":"Instituto de Ciencia de Materiales de Madrid","ror":"https://ror.org/02qqy8j09","country_code":"ES","type":"facility","lineage":["https://openalex.org/I134820265","https://openalex.org/I4210118429"]}],"countries":["ES"],"is_corresponding":false,"raw_author_name":"Federico Serrano-S\u00e1nchez","raw_affiliation_strings":["Instituto de Ciencia de Materiales de Madrid (ICMM), Consejo Superior de Investigaciones Cient\u00edficas (CSIC) , Sor Juana In\u00e9s de la Cruz 3, E-28049 , Madrid , Spain"],"raw_orcid":"https://orcid.org/0000-0002-6882-225X","affiliations":[{"raw_affiliation_string":"Instituto de Ciencia de Materiales de Madrid (ICMM), Consejo Superior de Investigaciones Cient\u00edficas (CSIC) , Sor Juana In\u00e9s de la Cruz 3, E-28049 , Madrid , Spain","institution_ids":["https://openalex.org/I134820265","https://openalex.org/I4210118429"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5087034622","display_name":"Norbert Marcel Nemes","orcid":"https://orcid.org/0000-0002-7856-3642","observed_orcids":["https://orcid.org/0000-0002-7856-3642"]},"institutions":[{"id":"https://openalex.org/I121748325","display_name":"Universidad Complutense de Madrid","ror":"https://ror.org/02p0gd045","country_code":"ES","type":"education","lineage":["https://openalex.org/I121748325"]}],"countries":["ES"],"is_corresponding":false,"raw_author_name":"Norbert M. Nemes","raw_affiliation_strings":["Departamento de F\u00edsica de Materiales , Universidad Complutense de Madrid , E-28040 Madrid , Spain"],"raw_orcid":"https://orcid.org/0000-0002-7856-3642","affiliations":[{"raw_affiliation_string":"Departamento de F\u00edsica de Materiales , Universidad Complutense de Madrid , E-28040 Madrid , Spain","institution_ids":["https://openalex.org/I121748325"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5063696184","display_name":"Oscar Juan Dura","orcid":"https://orcid.org/0000-0002-4014-7555","observed_orcids":["https://orcid.org/0000-0002-4014-7555"]},"institutions":[{"id":"https://openalex.org/I79189158","display_name":"University of Castilla-La Mancha","ror":"https://ror.org/05r78ng12","country_code":"ES","type":"education","lineage":["https://openalex.org/I79189158"]}],"countries":["ES"],"is_corresponding":false,"raw_author_name":"Oscar J. Dura","raw_affiliation_strings":["Departamento de F\u00edsica Aplicada , Universidad de Castilla-La Mancha , Ciudad Real , E-13071 , Spain"],"raw_orcid":"https://orcid.org/0000-0002-4014-7555","affiliations":[{"raw_affiliation_string":"Departamento de F\u00edsica Aplicada , Universidad de Castilla-La Mancha , Ciudad Real , E-13071 , Spain","institution_ids":["https://openalex.org/I79189158"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5100739718","display_name":"Jos\u00e9 Luis Mart\u00ednez","orcid":"https://orcid.org/0000-0001-9046-8237","observed_orcids":["https://orcid.org/0000-0001-9046-8237","https://orcid.org/0000-0002-4174-2794","https://orcid.org/0000-0001-5355-2106"]},"institutions":[{"id":"https://openalex.org/I134820265","display_name":"Consejo Superior de Investigaciones Cient\u00edficas","ror":"https://ror.org/02gfc7t72","country_code":"ES","type":"government","lineage":["https://openalex.org/I134820265"]},{"id":"https://openalex.org/I4210118429","display_name":"Instituto de Ciencia de Materiales de Madrid","ror":"https://ror.org/02qqy8j09","country_code":"ES","type":"facility","lineage":["https://openalex.org/I134820265","https://openalex.org/I4210118429"]}],"countries":["ES"],"is_corresponding":false,"raw_author_name":"Jose Luis Mart\u00ednez","raw_affiliation_strings":["Instituto de Ciencia de Materiales de Madrid (ICMM), Consejo Superior de Investigaciones Cient\u00edficas (CSIC) , Sor Juana In\u00e9s de la Cruz 3, E-28049 , Madrid , Spain"],"raw_orcid":"https://orcid.org/0000-0001-9046-8237","affiliations":[{"raw_affiliation_string":"Instituto de Ciencia de Materiales de Madrid (ICMM), Consejo Superior de Investigaciones Cient\u00edficas (CSIC) , Sor Juana In\u00e9s de la Cruz 3, E-28049 , Madrid , Spain","institution_ids":["https://openalex.org/I134820265","https://openalex.org/I4210118429"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5056795435","display_name":"J. A. Alonso","orcid":"https://orcid.org/0000-0001-5329-1225","observed_orcids":["https://orcid.org/0000-0001-5329-1225","https://orcid.org/0000-0002-8381-8849"]},"institutions":[{"id":"https://openalex.org/I134820265","display_name":"Consejo Superior de Investigaciones Cient\u00edficas","ror":"https://ror.org/02gfc7t72","country_code":"ES","type":"government","lineage":["https://openalex.org/I134820265"]},{"id":"https://openalex.org/I4210118429","display_name":"Instituto de Ciencia de Materiales de Madrid","ror":"https://ror.org/02qqy8j09","country_code":"ES","type":"facility","lineage":["https://openalex.org/I134820265","https://openalex.org/I4210118429"]}],"countries":["ES"],"is_corresponding":true,"raw_author_name":"Jose Antonio Alonso","raw_affiliation_strings":["Instituto de Ciencia de Materiales de Madrid (ICMM), Consejo Superior de Investigaciones Cient\u00edficas (CSIC) , Sor Juana In\u00e9s de la Cruz 3, E-28049 , Madrid , Spain"],"raw_orcid":"https://orcid.org/0000-0001-5329-1225","affiliations":[{"raw_affiliation_string":"Instituto de Ciencia de Materiales de Madrid (ICMM), Consejo Superior de Investigaciones Cient\u00edficas (CSIC) , Sor Juana In\u00e9s de la Cruz 3, E-28049 , Madrid , Spain","institution_ids":["https://openalex.org/I134820265","https://openalex.org/I4210118429"]}]}],"institutions":[],"countries_distinct_count":2,"institutions_distinct_count":5,"corresponding_author_ids":["https://openalex.org/A5056795435"],"corresponding_institution_ids":["https://openalex.org/I134820265","https://openalex.org/I4210118429"],"apc_list":{"value":2000,"currency":"EUR","value_usd":2107},"apc_paid":{"value":2000,"currency":"EUR","value_usd":2107},"fwci":0.0,"has_fulltext":false,"cited_by_count":1,"citation_normalized_percentile":{"value":0.06650513,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":91,"max":95},"biblio":{"volume":"238","issue":"1-2","first_page":"47","last_page":"56"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10440","display_name":"Advanced Thermoelectric Materials and Devices","score":0.9854000210762024,"subfield":{"id":"https://openalex.org/subfields/2505","display_name":"Materials Chemistry"},"field":{"id":"https://openalex.org/fields/25","display_name":"Materials Science"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},"topics":[{"id":"https://openalex.org/T10440","display_name":"Advanced Thermoelectric Materials and Devices","score":0.9854000210762024,"subfield":{"id":"https://openalex.org/subfields/2505","display_name":"Materials Chemistry"},"field":{"id":"https://openalex.org/fields/25","display_name":"Materials Science"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T10681","display_name":"Rare-earth and actinide compounds","score":0.005799999926239252,"subfield":{"id":"https://openalex.org/subfields/3104","display_name":"Condensed Matter Physics"},"field":{"id":"https://openalex.org/fields/31","display_name":"Physics and Astronomy"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T11277","display_name":"Thermal properties of materials","score":0.0026000000070780516,"subfield":{"id":"https://openalex.org/subfields/2505","display_name":"Materials Chemistry"},"field":{"id":"https://openalex.org/fields/25","display_name":"Materials Science"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/co4sb12","display_name":"Co4Sb12","score":0.9629999995231628}],"concepts":[{"id":"https://openalex.org/C198819137","wikidata":"https://www.wikidata.org/wiki/Q188884","display_name":"Octahedron","level":3,"score":0.5595452785491943},{"id":"https://openalex.org/C8010536","wikidata":"https://www.wikidata.org/wiki/Q160398","display_name":"Crystallography","level":1,"score":0.536244809627533},{"id":"https://openalex.org/C192562407","wikidata":"https://www.wikidata.org/wiki/Q228736","display_name":"Materials science","level":0,"score":0.48866894841194153},{"id":"https://openalex.org/C121332964","wikidata":"https://www.wikidata.org/wiki/Q413","display_name":"Physics","level":0,"score":0.4303343892097473},{"id":"https://openalex.org/C113196181","wikidata":"https://www.wikidata.org/wiki/Q485223","display_name":"Analytical Chemistry (journal)","level":2,"score":0.34052371978759766},{"id":"https://openalex.org/C115624301","wikidata":"https://www.wikidata.org/wiki/Q895901","display_name":"Crystal structure","level":2,"score":0.2652261555194855},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.20934179425239563},{"id":"https://openalex.org/C43617362","wikidata":"https://www.wikidata.org/wiki/Q170050","display_name":"Chromatography","level":1,"score":0.0}],"mesh":[],"locations_count":1,"locations":[{"id":"doi:10.1515/zkri-2022-0051","doi":"https://doi.org/10.1515/zkri-2022-0051","is_oa":true,"landing_page_url":"https://doi.org/10.1515/zkri-2022-0051","pdf_url":null,"source":{"id":"https://openalex.org/S4210205906","display_name":"Zeitschrift f\u00fcr Kristallographie - Crystalline Materials","issn_l":"2194-4946","issn":["2194-4946","2196-7105"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-c","jufo-1","poland-70","russia-white-list-2"],"host_organization":"https://openalex.org/P4310313990","host_organization_name":"De Gruyter","host_organization_lineage":["https://openalex.org/P4310313990"],"host_organization_lineage_names":["De Gruyter"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Zeitschrift f\u00fcr Kristallographie - Crystalline Materials","raw_type":"journal-article"}],"best_oa_location":{"id":"doi:10.1515/zkri-2022-0051","doi":"https://doi.org/10.1515/zkri-2022-0051","is_oa":true,"landing_page_url":"https://doi.org/10.1515/zkri-2022-0051","pdf_url":null,"source":{"id":"https://openalex.org/S4210205906","display_name":"Zeitschrift f\u00fcr Kristallographie - Crystalline Materials","issn_l":"2194-4946","issn":["2194-4946","2196-7105"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-c","jufo-1","poland-70","russia-white-list-2"],"host_organization":"https://openalex.org/P4310313990","host_organization_name":"De Gruyter","host_organization_lineage":["https://openalex.org/P4310313990"],"host_organization_lineage_names":["De Gruyter"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Zeitschrift f\u00fcr Kristallographie - Crystalline Materials","raw_type":"journal-article"},"sustainable_development_goals":[],"study_designs":[],"awards":[],"funders":[],"has_content":{"grobid_xml":false,"pdf":false},"content_urls":null,"referenced_works_count":32,"referenced_works":["https://openalex.org/W1959283661","https://openalex.org/W1981546048","https://openalex.org/W1998945616","https://openalex.org/W1998981899","https://openalex.org/W2016260972","https://openalex.org/W2019249776","https://openalex.org/W2026052659","https://openalex.org/W2043731326","https://openalex.org/W2057296915","https://openalex.org/W2094972715","https://openalex.org/W2104534021","https://openalex.org/W2115531048","https://openalex.org/W2126299467","https://openalex.org/W2137813091","https://openalex.org/W2148596493","https://openalex.org/W2155104348","https://openalex.org/W2163857577","https://openalex.org/W2323988707","https://openalex.org/W2566886294","https://openalex.org/W2748944719","https://openalex.org/W2771005366","https://openalex.org/W2892576271","https://openalex.org/W2921062006","https://openalex.org/W2950406042","https://openalex.org/W2950421517","https://openalex.org/W2999702770","https://openalex.org/W3041652322","https://openalex.org/W3157767708","https://openalex.org/W3198341685","https://openalex.org/W3203128900","https://openalex.org/W3203860343","https://openalex.org/W4205582716"],"related_works":["https://openalex.org/W4281729343","https://openalex.org/W2030532396","https://openalex.org/W4313389265","https://openalex.org/W3157767708","https://openalex.org/W2329604555","https://openalex.org/W2328931546","https://openalex.org/W4211231910","https://openalex.org/W2149390527","https://openalex.org/W2072627881","https://openalex.org/W2331969485"],"abstract_inverted_index":{"Abstract":[0],"Thermoelectric":[1],"M":[2,140],"x":[3],"Co4Sb12":[4],"skutterudites":[5],"are":[6,86],"well-known":[7],"to":[8,15,117],"exhibit":[9],"a":[10,58,138],"reduced":[11],"thermal":[12,174],"conductivity":[13,175],"thanks":[14],"the":[16,20,23,28,32,36,96,109,113,128,135,144,149,199,218],"rattling":[17],"effect":[18],"of":[19,35,122,177,191,203],"M-filler":[21],"at":[22,31,54,88,184,206],"large":[24],"cages":[25,98],"occurring":[26],"in":[27,57,148,169],"framework,":[29],"centered":[30],"2a":[33,100],"sites":[34],"I":[37],"m":[38],"3":[39],"\u203e":[40],"$Im\\overline{3}$":[41],"space":[42],"group.":[43],"A":[44,172],"novel":[45,145],"Eu-filled":[46],"skutterudite":[47],"has":[48],"been":[49],"synthesized":[50],"under":[51,157],"high-pressure":[52,219],"conditions":[53],"3.5":[55],"GPa":[56],"piston-cylinder":[59],"hydrostatic":[60],"press.":[61],"The":[62,102],"structural":[63],"refinement":[64],"from":[65],"high-angular":[66],"resolution":[67],"synchrotron":[68],"X-ray":[69],"diffraction":[70],"(SXRD)":[71],"patterns":[72],"unveils":[73],"an":[74],"unusual":[75],"position":[76],"for":[77,152,187],"Eu":[78,146,204],"filler":[79],"atoms.":[80],"By":[81],"difference":[82],"Fourier":[83],"synthesis":[84],"they":[85],"found":[87],"12d":[89,207],"sites,":[90],"conforming":[91],"statistically":[92],"occupied":[93],"octahedra":[94],"within":[95],"mentioned":[97],"around":[99],"positions.":[101],"Debye":[103],"temperature":[104],"was":[105],"estimated":[106],"by":[107,112,198],"averaging":[108],"isotropic":[110],"displacements":[111],"atomic":[114],"masses,":[115],"leading":[116],"\u03b8":[118],"D":[119],"${\\theta":[120],"}_{D}$":[121],"273(2)":[123],"K.":[124],"Oftedal":[125],"plots":[126],"concerning":[127],"y":[129],"and":[130,139],"z":[131],"Sb":[132],"fractional":[133],"positions,":[134],"unit-cell":[136],"parameter":[137],"filling":[141],"fraction":[142],"include":[143],"specimen":[147],"trend":[150],"observed":[151],"other":[153,192],"filled":[154,170,193],"materials":[155],"prepared":[156],"high-pressure,":[158],"including":[159],"rare-earths,":[160],"alkali":[161],"or":[162],"alkali-earth":[163],"elements,":[164],"all":[165],"accepted":[166],"as":[167],"rattlers":[168],"skutterudites.":[171],"total":[173],"(\u03ba)":[176],"0.82":[178],"W":[179],"m\u22121":[180],"K\u22121":[181],"is":[182,196],"measured":[183],"773":[185],"K":[186],"Eu0.02(1)Co4Sb12,":[188],"below":[189],"that":[190],"skutterudites,":[194],"which":[195],"promoted":[197],"enhanced":[200],"phonon":[201],"scattering":[202],"located":[205],"sites.":[208],"FE-SEM":[209],"images":[210],"showed":[211],"large,":[212],"homogeneous":[213],"grains,":[214],"well":[215],"compacted":[216],"after":[217],"synthesis.":[220]},"counts_by_year":[{"year":2026,"cited_by_count":1}],"updated_date":"2026-10-13T10:08:12.033832","created_date":"2022-12-23T00:00:00"}