{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,10,7]],"date-time":"2026-10-07T17:51:46Z","timestamp":1791395506024,"version":"4.3.3"},"reference-count":61,"publisher":"Royal Society of Chemistry (RSC)","issue":"59","license":[{"start":{"date-parts":[[2026,8,28]],"date-time":"2026-08-28T00:00:00Z","timestamp":1787875200000},"content-version":"vor","delay-in-days":239,"URL":"http:\/\/creativecommons.org\/licenses\/by\/3.0\/"}],"funder":[{"DOI":"10.13039\/501100000741","name":"The University of Warwick","doi-asserted-by":"publisher","award":["EP\/T022108\/1"],"award-info":[{"award-number":["EP\/T022108\/1"]}],"id":[{"id":"10.13039\/501100000741","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100000266","name":"Engineering and Physical Sciences Research Council","doi-asserted-by":"publisher","award":["EP\/L000202"],"award-info":[{"award-number":["EP\/L000202"]}],"id":[{"id":"10.13039\/501100000266","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100000266","name":"Engineering and Physical Sciences Research Council","doi-asserted-by":"publisher","award":["EP\/R029431"],"award-info":[{"award-number":["EP\/R029431"]}],"id":[{"id":"10.13039\/501100000266","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100000266","name":"Engineering and Physical Sciences Research Council","doi-asserted-by":"publisher","award":["EP\/T022213"],"award-info":[{"award-number":["EP\/T022213"]}],"id":[{"id":"10.13039\/501100000266","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100000266","name":"Engineering and Physical Sciences Research Council","doi-asserted-by":"publisher","award":["EP\/T022221\/1"],"award-info":[{"award-number":["EP\/T022221\/1"]}],"id":[{"id":"10.13039\/501100000266","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100000266","name":"Engineering and Physical Sciences Research Council","doi-asserted-by":"publisher","award":["EP\/W032244\/1"],"award-info":[{"award-number":["EP\/W032244\/1"]}],"id":[{"id":"10.13039\/501100000266","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":["rsc.org"],"crossmark-restriction":true},"short-container-title":["J. Mater. Chem. A"],"abstract":"<jats:p>\n                    Defect engineering of the earth-abundant layered phosphide BaCuP: La doping tunes the intrinsic hole concentration towards the optimum, giving a peak\n                    <jats:italic>zT<\/jats:italic>\n                    of 0.69 at 800 K, the highest among 1-1-1 phosphides.\n                  <\/jats:p>","DOI":"10.1039\/d6ta05718g","type":"journal-article","created":{"date-parts":[[2026,8,28]],"date-time":"2026-08-28T13:23:25Z","timestamp":1787923405000},"page":"40794-40804","update-policy":"https:\/\/doi.org\/10.1039\/rsc_crossmark_policy","source":"Crossref","is-referenced-by-count":0,"title":["Optimizing the thermoelectric performance of the earth-abundant layered phosphide BaCuP through defect engineering"],"prefix":"10.1039","volume":"14","author":[{"ORCID":"https:\/\/orcid.org\/0009-0000-5746-7419","authenticated-orcid":false,"given":"Romain","family":"Claes","sequence":"first","affiliation":[{"name":"School of Chemistry, University of Birmingham, Edgbaston, Birmingham, B15 2 TT, UK"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0009-0007-8545-7956","authenticated-orcid":false,"given":"Peter P.","family":"Russell","sequence":"additional","affiliation":[{"name":"School of Chemistry, University of Birmingham, Edgbaston, Birmingham, B15 2 TT, UK"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-6967-3690","authenticated-orcid":false,"given":"Alexander G.","family":"Squires","sequence":"additional","affiliation":[{"name":"School of Chemistry, University of Birmingham, Edgbaston, Birmingham, B15 2 TT, UK"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-9174-8601","authenticated-orcid":false,"given":"David O.","family":"Scanlon","sequence":"additional","affiliation":[{"name":"School of Chemistry, University of Birmingham, Edgbaston, Birmingham, B15 2 TT, UK"}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"292","published-online":{"date-parts":[[2026]]},"reference":[{"key":"D6TA05718G\/cit1\/1","volume-title":"CRC handbook of thermoelectrics","author":"Rowe","year":"1995","unstructured":"D. M.Rowe ,  CRC handbook of thermoelectrics ,  CRC press ,  1995"},{"key":"D6TA05718G\/cit2\/1","doi-asserted-by":"crossref","first-page":"105","DOI":"10.1038\/nmat2090","volume":"7","author":"Snyder","year":"2008","journal-title":"Nat. Mater."},{"key":"D6TA05718G\/cit3\/1","doi-asserted-by":"crossref","first-page":"011339","DOI":"10.1063\/5.0241645","volume":"12","author":"Park","year":"2025","journal-title":"Appl. Phys. Rev."},{"key":"D6TA05718G\/cit4\/1","doi-asserted-by":"crossref","first-page":"1314","DOI":"10.1016\/j.apenergy.2018.10.102","volume":"235","author":"Firth","year":"2019","journal-title":"Appl. Energy"},{"key":"D6TA05718G\/cit5\/1","doi-asserted-by":"crossref","first-page":"414","DOI":"10.1038\/nature11439","volume":"489","author":"Biswas","year":"2012","journal-title":"Nature"},{"key":"D6TA05718G\/cit6\/1","doi-asserted-by":"crossref","first-page":"81","DOI":"10.1126\/science.adj8175","volume":"384","author":"Jia","year":"2024","journal-title":"Science"},{"key":"D6TA05718G\/cit7\/1","doi-asserted-by":"crossref","first-page":"597","DOI":"10.1038\/35098012","volume":"413","author":"Venkatasubramanian","year":"2001","journal-title":"Nature"},{"key":"D6TA05718G\/cit8\/1","doi-asserted-by":"crossref","first-page":"634","DOI":"10.1126\/science.1156446","volume":"320","author":"Poudel","year":"2008","journal-title":"Science"},{"key":"D6TA05718G\/cit9\/1","doi-asserted-by":"crossref","first-page":"373","DOI":"10.1038\/nature13184","volume":"508","author":"Zhao","year":"2014","journal-title":"Nature"},{"key":"D6TA05718G\/cit10\/1","doi-asserted-by":"crossref","first-page":"1378","DOI":"10.1038\/s41563-021-01064-6","volume":"20","author":"Zhou","year":"2021","journal-title":"Nat. Mater."},{"key":"D6TA05718G\/cit11\/1","doi-asserted-by":"crossref","first-page":"74","DOI":"10.1016\/j.mtphys.2017.06.003","volume":"1","author":"Shuai","year":"2017","journal-title":"Mater. Today Phys."},{"key":"D6TA05718G\/cit12\/1","doi-asserted-by":"crossref","first-page":"246","DOI":"10.1016\/j.nanoen.2018.07.059","volume":"52","author":"Chen","year":"2018","journal-title":"Nano Energy"},{"key":"D6TA05718G\/cit13\/1","doi-asserted-by":"crossref","first-page":"100597","DOI":"10.1016\/j.mtphys.2021.100597","volume":"22","author":"Smiadak","year":"2022","journal-title":"Mater. Today Phys."},{"key":"D6TA05718G\/cit14\/1","doi-asserted-by":"crossref","first-page":"22660","DOI":"10.1039\/D1TA04958E","volume":"9","author":"Sato","year":"2021","journal-title":"J. Mater. Chem. A"},{"key":"D6TA05718G\/cit15\/1","doi-asserted-by":"crossref","first-page":"35507","DOI":"10.1039\/D5TA05523G","volume":"13","author":"Bi","year":"2025","journal-title":"J. Mater. Chem. A"},{"key":"D6TA05718G\/cit16\/1","doi-asserted-by":"crossref","first-page":"041319","DOI":"10.1063\/5.0263175","volume":"12","author":"Katase","year":"2025","journal-title":"Appl. Phys. Rev."},{"key":"D6TA05718G\/cit17\/1","doi-asserted-by":"crossref","first-page":"8453","DOI":"10.1039\/D3TA00620D","volume":"11","author":"Quinn","year":"2023","journal-title":"J. Mater. Chem. A"},{"key":"D6TA05718G\/cit18\/1","doi-asserted-by":"crossref","first-page":"9150","DOI":"10.1021\/acsami.9b17269","volume":"12","author":"Suwardi","year":"2020","journal-title":"ACS Appl. Mater. Interfaces"},{"key":"D6TA05718G\/cit19\/1","doi-asserted-by":"crossref","first-page":"073903","DOI":"10.1063\/5.0080163","volume":"120","author":"Quinn","year":"2022","journal-title":"Appl. Phys. Lett."},{"key":"D6TA05718G\/cit20\/1","doi-asserted-by":"crossref","first-page":"5872","DOI":"10.1039\/D2SC01538B","volume":"13","author":"Willis","year":"2022","journal-title":"Chem. Sci."},{"key":"D6TA05718G\/cit21\/1","doi-asserted-by":"crossref","first-page":"1620","DOI":"10.1021\/acs.chemmater.1c03619","volume":"34","author":"Fan","year":"2022","journal-title":"Chem. Mater."},{"key":"D6TA05718G\/cit22\/1","doi-asserted-by":"crossref","first-page":"6167","DOI":"10.1038\/s41467-020-19850-2","volume":"11","author":"Han","year":"2020","journal-title":"Nat. Commun."},{"key":"D6TA05718G\/cit23\/1","doi-asserted-by":"crossref","first-page":"54241","DOI":"10.1021\/acsami.4c12963","volume":"16","author":"Namiki","year":"2024","journal-title":"ACS Appl. Mater. Interfaces"},{"key":"D6TA05718G\/cit24\/1","doi-asserted-by":"crossref","first-page":"983","DOI":"10.1515\/znb-1978-0906","volume":"33","author":"Mewis","year":"1978","journal-title":"Z. Naturforsch. B Chem. Sci."},{"key":"D6TA05718G\/cit25\/1","doi-asserted-by":"crossref","first-page":"1373","DOI":"10.1515\/znb-1979-1006","volume":"34","author":"Mewis","year":"1979","journal-title":"Z. Naturforsch. B Chem. Sci."},{"key":"D6TA05718G\/cit26\/1","doi-asserted-by":"crossref","first-page":"169123","DOI":"10.1016\/j.jallcom.2023.169123","volume":"942","author":"Moll","year":"2023","journal-title":"J. Alloys Compd."},{"key":"D6TA05718G\/cit27\/1","doi-asserted-by":"crossref","first-page":"11811","DOI":"10.1039\/D2CC03154J","volume":"58","author":"Quinn","year":"2022","journal-title":"Chem. Commun."},{"key":"D6TA05718G\/cit28\/1","doi-asserted-by":"crossref","first-page":"2879","DOI":"10.1021\/acsaelm.3c00828","volume":"6","author":"Quinn","year":"2023","journal-title":"ACS Appl. Electron. Mater."},{"key":"D6TA05718G\/cit29\/1","doi-asserted-by":"crossref","first-page":"16","DOI":"10.1002\/aelm.202500303","volume":"11","author":"Aktas","year":"2025","journal-title":"Adv. Electron. Mater."},{"key":"D6TA05718G\/cit30\/1","doi-asserted-by":"crossref","first-page":"14251","DOI":"10.1103\/PhysRevB.49.14251","volume":"49","author":"Kresse","year":"1994","journal-title":"Phys. Rev. B"},{"key":"D6TA05718G\/cit31\/1","doi-asserted-by":"crossref","first-page":"15","DOI":"10.1016\/0927-0256(96)00008-0","volume":"6","author":"Kresse","year":"1996","journal-title":"Comput. Mater. Sci."},{"key":"D6TA05718G\/cit32\/1","doi-asserted-by":"crossref","first-page":"224106","DOI":"10.1063\/1.2404663","volume":"125","author":"Krukau","year":"2006","journal-title":"J. Chem. Phys."},{"key":"D6TA05718G\/cit33\/1","doi-asserted-by":"crossref","first-page":"6433","DOI":"10.21105\/joss.06433","volume":"9","author":"Kavanagh","year":"2024","journal-title":"J. Open Source Softw."},{"key":"D6TA05718G\/cit34\/1","doi-asserted-by":"crossref","first-page":"4817","DOI":"10.21105\/joss.04817","volume":"7","author":"Mosquera-Lois","year":"2022","journal-title":"J. Open Source Softw."},{"key":"D6TA05718G\/cit35\/1","doi-asserted-by":"crossref","first-page":"25","DOI":"10.1038\/s41524-023-00973-1","volume":"9","author":"Mosquera-Lois","year":"2023","journal-title":"npj Comput. Mater."},{"key":"D6TA05718G\/cit36\/1","doi-asserted-by":"crossref","first-page":"469","DOI":"10.1038\/s41578-025-00879-y","volume":"11","author":"Squires","year":"2026","journal-title":"Nat. Rev. Mater."},{"key":"D6TA05718G\/cit37\/1","doi-asserted-by":"crossref","first-page":"6264","DOI":"10.21105\/joss.06264","volume":"9","author":"Lindgren","year":"2024","journal-title":"J. Open Source Softw."},{"key":"D6TA05718G\/cit38\/1","doi-asserted-by":"crossref","first-page":"114801","DOI":"10.1063\/5.0106617","volume":"157","author":"Fan","year":"2022","journal-title":"J. Chem. Phys."},{"key":"D6TA05718G\/cit39\/1","first-page":"3","volume":"3","author":"Xu","year":"2025","journal-title":"Mater. Genome Eng. Adv."},{"key":"D6TA05718G\/cit40\/1","doi-asserted-by":"crossref","first-page":"064308","DOI":"10.1103\/PhysRevB.99.064308","volume":"99","author":"Fan","year":"2019","journal-title":"Phys. Rev. B"},{"key":"D6TA05718G\/cit41\/1","doi-asserted-by":"crossref","first-page":"161101","DOI":"10.1063\/5.0200833","volume":"135","author":"Dong","year":"2024","journal-title":"J. Appl. Phys."},{"key":"D6TA05718G\/cit42\/1","doi-asserted-by":"crossref","first-page":"2222","DOI":"10.1038\/s41467-021-22440-5","volume":"12","author":"Ganose","year":"2021","journal-title":"Nat. Commun."},{"key":"D6TA05718G\/cit43\/1","doi-asserted-by":"crossref","first-page":"094302","DOI":"10.1103\/PhysRevB.106.094302","volume":"106","author":"Claes","year":"2022","journal-title":"Phys. Rev. B"},{"key":"D6TA05718G\/cit44\/1","doi-asserted-by":"crossref","first-page":"73","DOI":"10.1038\/s42254-024-00795-0","volume":"7","author":"Claes","year":"2025","journal-title":"Nat. Rev. Phys."},{"key":"D6TA05718G\/cit45\/1","doi-asserted-by":"crossref","first-page":"8995","DOI":"10.1021\/acs.chemmater.3c01628","volume":"35","author":"Willis","year":"2023","journal-title":"Chem. Mater."},{"key":"D6TA05718G\/cit46\/1","doi-asserted-by":"crossref","first-page":"2402","DOI":"10.1021\/acs.chemmater.6b03306","volume":"29","author":"Williamson","year":"2017","journal-title":"Chem. Mater."},{"key":"D6TA05718G\/cit47\/1","doi-asserted-by":"crossref","first-page":"717","DOI":"10.21105\/joss.00717","volume":"3","author":"Ganose","year":"2018","journal-title":"J. Open Source Softw."},{"key":"D6TA05718G\/cit48\/1","doi-asserted-by":"crossref","first-page":"330","DOI":"10.1016\/j.cpc.2013.08.026","volume":"185","author":"Buckeridge","year":"2014","journal-title":"Comput. Phys. Commun."},{"key":"D6TA05718G\/cit49\/1","doi-asserted-by":"crossref","first-page":"21","DOI":"10.1002\/adma.201900108","volume":"31","author":"Hanus","year":"2019","journal-title":"Adv. Mater."},{"key":"D6TA05718G\/cit50\/1","doi-asserted-by":"crossref","first-page":"037201","DOI":"10.1088\/1674-1056\/ae1c22","volume":"35","author":"Wang","year":"2026","journal-title":"Chin. Phys. B"},{"key":"D6TA05718G\/cit51\/1","doi-asserted-by":"crossref","first-page":"094306","DOI":"10.1103\/PhysRevB.91.094306","volume":"91","author":"Togo","year":"2015","journal-title":"Phys. Rev. B:Condens. Matter Mater. Phys."},{"key":"D6TA05718G\/cit52\/1","first-page":"353001","volume":"35","author":"Togo","year":"2023","journal-title":"J. Phys.: Condens. Matter"},{"key":"D6TA05718G\/cit53\/1","doi-asserted-by":"crossref","first-page":"13400","DOI":"10.1039\/D4CC04660A","volume":"60","author":"Jong","year":"2024","journal-title":"Chem. Commun."},{"key":"D6TA05718G\/cit54\/1","doi-asserted-by":"crossref","first-page":"133905","DOI":"10.1063\/5.0142157","volume":"122","author":"Jong","year":"2023","journal-title":"Appl. Phys. Lett."},{"key":"D6TA05718G\/cit55\/1","doi-asserted-by":"crossref","first-page":"16032","DOI":"10.1038\/natrevmats.2016.32","volume":"1","author":"Zeier","year":"2016","journal-title":"Nat. Rev. Mater."},{"key":"D6TA05718G\/cit56\/1","doi-asserted-by":"crossref","first-page":"13576","DOI":"10.1073\/pnas.1617663113","volume":"113","author":"He","year":"2016","journal-title":"Proc. Natl. Acad. Sci. U. S. A."},{"key":"D6TA05718G\/cit57\/1","doi-asserted-by":"crossref","first-page":"5155","DOI":"10.1021\/acsaem.1c00687","volume":"4","author":"Shinozaki","year":"2021","journal-title":"ACS Appl. Energy Mater."},{"key":"D6TA05718G\/cit58\/1","doi-asserted-by":"crossref","first-page":"155406","DOI":"10.1088\/0022-3727\/44\/15\/155406","volume":"44","author":"Ponnambalam","year":"2011","journal-title":"J. Phys. D: Appl. Phys."},{"key":"D6TA05718G\/cit59\/1","doi-asserted-by":"crossref","first-page":"4861","DOI":"10.1021\/acsaem.1c00445","volume":"4","author":"Mark","year":"2021","journal-title":"ACS Appl. Energy Mater."},{"key":"D6TA05718G\/cit60\/1","doi-asserted-by":"crossref","first-page":"209","DOI":"10.1039\/D0MH01112F","volume":"8","author":"P\u00f6hls","year":"2021","journal-title":"Mater. Horiz."},{"key":"D6TA05718G\/cit61\/1","doi-asserted-by":"crossref","first-page":"8030","DOI":"10.1039\/C7SC03482B","volume":"8","author":"Wang","year":"2017","journal-title":"Chem. Sci."}],"container-title":["Journal of Materials Chemistry A"],"original-title":[],"language":"en","link":[{"URL":"http:\/\/pubs.rsc.org\/TA\/article-pdf\/doi\/10.1039\/D6TA05718G\/0\/D6TA05718G.pdf","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2026,10,7]],"date-time":"2026-10-07T17:00:19Z","timestamp":1791392419000},"score":1,"resource":{"primary":{"URL":"http:\/\/pubs.rsc.org\/TA\/article-lookup\/doi\/10.1039\/D6TA05718G"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2026]]},"references-count":61,"journal-issue":{"issue":"59","published-print":{"date-parts":[[2026,10,7]]}},"URL":"https:\/\/doi.org\/10.1039\/d6ta05718g","relation":{"has-preprint":[{"id-type":"doi","id":"10.26434\/chemrxiv.15005826\/v1","asserted-by":"object"}]},"ISSN":["2050-7488","2050-7496"],"issn-type":[{"value":"2050-7488","type":"print"},{"value":"2050-7496","type":"electronic"}],"subject":[],"published":{"date-parts":[[2026]]}}}