{"id":"https://openalex.org/W4362736795","doi":"https://doi.org/10.1021/acs.jpcc.3c00069","title":"Quantum Interference and Contact Effects in the Thermoelectric Performance of Anthracene-Based Molecules","display_name":"Quantum Interference and Contact Effects in the Thermoelectric Performance of Anthracene-Based Molecules","publication_year":2023,"publication_date":"2023-04-10","ids":{"openalex":"https://openalex.org/W4362736795","doi":"https://doi.org/10.1021/acs.jpcc.3c00069","pmid":"https://pubmed.ncbi.nlm.nih.gov/37113454","pmcid":"https://www.ncbi.nlm.nih.gov/pmc/articles/10123663"},"language":"en","primary_location":{"id":"doi:10.1021/acs.jpcc.3c00069","doi":"https://doi.org/10.1021/acs.jpcc.3c00069","is_oa":true,"landing_page_url":"https://doi.org/10.1021/acs.jpcc.3c00069","pdf_url":"https://pubs.acs.org/doi/pdf/10.1021/acs.jpcc.3c00069","source":{"id":"https://openalex.org/S95739953","display_name":"The Journal of Physical Chemistry C","issn_l":"1932-7447","issn":["1932-7447","1932-7455"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-c","jufo-2","ki-jl-1","norway-1","poland-140","russia-white-list-1","vabb-shw"],"host_organization":"https://openalex.org/P4310320006","host_organization_name":"American Chemical Society","host_organization_lineage":["https://openalex.org/P4310320006"],"host_organization_lineage_names":["American Chemical Society"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"The Journal of Physical Chemistry C","raw_type":"journal-article"},"volume":null,"type":"article","is_traditional":true,"indexed_in":["arxiv","crossref","datacite","pubmed"],"open_access":{"is_oa":true,"oa_status":"hybrid","oa_url":"https://pubs.acs.org/doi/pdf/10.1021/acs.jpcc.3c00069","any_repository_has_fulltext":true},"authorships":[{"author_position":"first","author":{"id":null,"display_name":"Joseph M. Hamill","orcid":"https://orcid.org/0000-0002-9024-4636","observed_orcids":["https://orcid.org/0000-0002-9024-4636"]},"institutions":[{"id":"https://openalex.org/I79619799","display_name":"University of Birmingham","ror":"https://ror.org/03angcq70","country_code":"GB","type":"education","lineage":["https://openalex.org/I79619799"]}],"countries":["GB"],"is_corresponding":true,"raw_author_name":"Joseph M. Hamill","raw_affiliation_strings":["School of Chemistry, University of Birmingham, Edgbaston Campus, Birmingham B15 2TT, U.K"],"raw_orcid":"https://orcid.org/0000-0002-9024-4636","affiliations":[{"raw_affiliation_string":"School of Chemistry, University of Birmingham, Edgbaston Campus, Birmingham B15 2TT, U.K","institution_ids":["https://openalex.org/I79619799"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5013635512","display_name":"Ali Khalid Ismael","orcid":"https://orcid.org/0000-0001-7943-3519","observed_orcids":["https://orcid.org/0000-0001-7943-3519"]},"institutions":[{"id":"https://openalex.org/I67415387","display_name":"Lancaster University","ror":"https://ror.org/04f2nsd36","country_code":"GB","type":"education","lineage":["https://openalex.org/I67415387"]}],"countries":["GB"],"is_corresponding":true,"raw_author_name":"Ali Ismael","raw_affiliation_strings":["Physics Department, Lancaster University, Lancaster LA1 4YB, U.K"],"raw_orcid":"https://orcid.org/0000-0001-7943-3519","affiliations":[{"raw_affiliation_string":"Physics Department, Lancaster University, Lancaster LA1 4YB, U.K","institution_ids":["https://openalex.org/I67415387"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5078817698","display_name":"Alaa A. Al\u2010Jobory","orcid":"https://orcid.org/0000-0002-8001-8010","observed_orcids":["https://orcid.org/0000-0002-8001-8010"]},"institutions":[{"id":"https://openalex.org/I27768575","display_name":"University of Anbar","ror":"https://ror.org/055a6gk50","country_code":"IQ","type":"education","lineage":["https://openalex.org/I27768575"]},{"id":"https://openalex.org/I67415387","display_name":"Lancaster University","ror":"https://ror.org/04f2nsd36","country_code":"GB","type":"education","lineage":["https://openalex.org/I67415387"]}],"countries":["GB","IQ"],"is_corresponding":false,"raw_author_name":"Alaa Al-Jobory","raw_affiliation_strings":["Department of Physics, College of Science, University of Anbar, Ramadi 31001, Anbar, Iraq","Physics Department, Lancaster University, Lancaster LA1 4YB, U.K"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Physics, College of Science, University of Anbar, Ramadi 31001, Anbar, Iraq","institution_ids":["https://openalex.org/I27768575"]},{"raw_affiliation_string":"Physics Department, Lancaster University, Lancaster LA1 4YB, U.K","institution_ids":["https://openalex.org/I67415387"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5043329696","display_name":"Troy L. R. Bennett","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I47508984","display_name":"Imperial College London","ror":"https://ror.org/041kmwe10","country_code":"GB","type":"education","lineage":["https://openalex.org/I47508984"]}],"countries":["GB"],"is_corresponding":false,"raw_author_name":"Troy L. R. Bennett","raw_affiliation_strings":["Department of Chemistry, Imperial College London, MSRH, White City, London W12 0BZ, U.K"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemistry, Imperial College London, MSRH, White City, London W12 0BZ, U.K","institution_ids":["https://openalex.org/I47508984"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5050835950","display_name":"M.D. Alshahrani","orcid":"https://orcid.org/0009-0005-2984-1326","observed_orcids":["https://orcid.org/0009-0005-2984-1326"]},"institutions":[{"id":"https://openalex.org/I4210136004","display_name":"University of Bisha","ror":"https://ror.org/040548g92","country_code":"SA","type":"education","lineage":["https://openalex.org/I4210136004"]},{"id":"https://openalex.org/I67415387","display_name":"Lancaster University","ror":"https://ror.org/04f2nsd36","country_code":"GB","type":"education","lineage":["https://openalex.org/I67415387"]}],"countries":["GB","SA"],"is_corresponding":false,"raw_author_name":"Maryam Alshahrani","raw_affiliation_strings":["Physics Department, College of Science, University of Bisha, P.O. Box 344, Bisha 61922, Kingdom of Saudi Arabia","Physics Department, Lancaster University, Lancaster LA1 4YB, U.K"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Physics Department, College of Science, University of Bisha, P.O. Box 344, Bisha 61922, Kingdom of Saudi Arabia","institution_ids":["https://openalex.org/I4210136004"]},{"raw_affiliation_string":"Physics Department, Lancaster University, Lancaster LA1 4YB, U.K","institution_ids":["https://openalex.org/I67415387"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5085388352","display_name":"Xintai Wang","orcid":"https://orcid.org/0000-0002-6151-414X","observed_orcids":["https://orcid.org/0000-0002-6151-414X"]},"institutions":[{"id":"https://openalex.org/I43313876","display_name":"Dalian Maritime University","ror":"https://ror.org/002b7nr53","country_code":"CN","type":"education","lineage":["https://openalex.org/I43313876"]},{"id":"https://openalex.org/I67415387","display_name":"Lancaster University","ror":"https://ror.org/04f2nsd36","country_code":"GB","type":"education","lineage":["https://openalex.org/I67415387"]}],"countries":["CN","GB"],"is_corresponding":false,"raw_author_name":"Xintai Wang","raw_affiliation_strings":["Physics Department, Lancaster University, Lancaster LA1 4YB, U.K","School of Information Science and Technology, Dalian Maritime University, Dalian 116026, China"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Physics Department, Lancaster University, Lancaster LA1 4YB, U.K","institution_ids":["https://openalex.org/I67415387"]},{"raw_affiliation_string":"School of Information Science and Technology, Dalian Maritime University, Dalian 116026, China","institution_ids":["https://openalex.org/I43313876"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5007687293","display_name":"Maxwell Akers-Douglas","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I47508984","display_name":"Imperial College London","ror":"https://ror.org/041kmwe10","country_code":"GB","type":"education","lineage":["https://openalex.org/I47508984"]}],"countries":["GB"],"is_corresponding":false,"raw_author_name":"Maxwell Akers-Douglas","raw_affiliation_strings":["Department of Chemistry, Imperial College London, MSRH, White City, London W12 0BZ, U.K"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemistry, Imperial College London, MSRH, White City, London W12 0BZ, U.K","institution_ids":["https://openalex.org/I47508984"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5107971215","display_name":"Luke A. Wilkinson","orcid":"https://orcid.org/0000-0002-8550-3226","observed_orcids":["https://orcid.org/0000-0002-8550-3226"]},"institutions":[{"id":"https://openalex.org/I47508984","display_name":"Imperial College London","ror":"https://ror.org/041kmwe10","country_code":"GB","type":"education","lineage":["https://openalex.org/I47508984"]}],"countries":["GB"],"is_corresponding":false,"raw_author_name":"Luke A. Wilkinson","raw_affiliation_strings":["Department of Chemistry, Imperial College London, MSRH, White City, London W12 0BZ, U.K"],"raw_orcid":"https://orcid.org/0000-0002-8550-3226","affiliations":[{"raw_affiliation_string":"Department of Chemistry, Imperial College London, MSRH, White City, London W12 0BZ, U.K","institution_ids":["https://openalex.org/I47508984"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5076914161","display_name":"Benjamin J. Robinson","orcid":"https://orcid.org/0000-0001-8676-6469","observed_orcids":["https://orcid.org/0000-0001-8676-6469"]},"institutions":[{"id":"https://openalex.org/I67415387","display_name":"Lancaster University","ror":"https://ror.org/04f2nsd36","country_code":"GB","type":"education","lineage":["https://openalex.org/I67415387"]}],"countries":["GB"],"is_corresponding":false,"raw_author_name":"Benjamin J. Robinson","raw_affiliation_strings":["Physics Department, Lancaster University, Lancaster LA1 4YB, U.K"],"raw_orcid":"https://orcid.org/0000-0001-8676-6469","affiliations":[{"raw_affiliation_string":"Physics Department, Lancaster University, Lancaster LA1 4YB, U.K","institution_ids":["https://openalex.org/I67415387"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5000200207","display_name":"Nicholas J. Long","orcid":"https://orcid.org/0000-0002-8298-938X","observed_orcids":["https://orcid.org/0000-0002-8298-938X"]},"institutions":[{"id":"https://openalex.org/I47508984","display_name":"Imperial College London","ror":"https://ror.org/041kmwe10","country_code":"GB","type":"education","lineage":["https://openalex.org/I47508984"]}],"countries":["GB"],"is_corresponding":false,"raw_author_name":"Nicholas J. Long","raw_affiliation_strings":["Department of Chemistry, Imperial College London, MSRH, White City, London W12 0BZ, U.K"],"raw_orcid":"https://orcid.org/0000-0002-8298-938X","affiliations":[{"raw_affiliation_string":"Department of Chemistry, Imperial College London, MSRH, White City, London W12 0BZ, U.K","institution_ids":["https://openalex.org/I47508984"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5026323087","display_name":"Colin John Lambert","orcid":"https://orcid.org/0000-0003-2332-9610","observed_orcids":["https://orcid.org/0000-0003-2332-9610"]},"institutions":[{"id":"https://openalex.org/I67415387","display_name":"Lancaster University","ror":"https://ror.org/04f2nsd36","country_code":"GB","type":"education","lineage":["https://openalex.org/I67415387"]}],"countries":["GB"],"is_corresponding":true,"raw_author_name":"Colin Lambert","raw_affiliation_strings":["Physics Department, Lancaster University, Lancaster LA1 4YB, U.K"],"raw_orcid":"https://orcid.org/0000-0003-2332-9610","affiliations":[{"raw_affiliation_string":"Physics Department, Lancaster University, Lancaster LA1 4YB, U.K","institution_ids":["https://openalex.org/I67415387"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5012485649","display_name":"Tim Albrecht","orcid":"https://orcid.org/0000-0001-6085-3206","observed_orcids":["https://orcid.org/0000-0001-6085-3206"]},"institutions":[{"id":"https://openalex.org/I79619799","display_name":"University of Birmingham","ror":"https://ror.org/03angcq70","country_code":"GB","type":"education","lineage":["https://openalex.org/I79619799"]}],"countries":["GB"],"is_corresponding":true,"raw_author_name":"Tim Albrecht","raw_affiliation_strings":["School of Chemistry, University of Birmingham, Edgbaston Campus, Birmingham B15 2TT, U.K"],"raw_orcid":"https://orcid.org/0000-0001-6085-3206","affiliations":[{"raw_affiliation_string":"School of Chemistry, University of Birmingham, Edgbaston Campus, Birmingham B15 2TT, U.K","institution_ids":["https://openalex.org/I79619799"]}]}],"institutions":[],"countries_distinct_count":4,"institutions_distinct_count":6,"corresponding_author_ids":["https://openalex.org/A5012485649","https://openalex.org/A5013635512","https://openalex.org/A5026323087"],"corresponding_institution_ids":["https://openalex.org/I67415387","https://openalex.org/I79619799"],"apc_list":{"value":5000,"currency":"USD","value_usd":5000},"apc_paid":{"value":5000,"currency":"USD","value_usd":5000},"fwci":1.7817,"has_fulltext":true,"cited_by_count":25,"citation_normalized_percentile":{"value":0.84401918,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":95,"max":99},"biblio":{"volume":"127","issue":"15","first_page":"7484","last_page":"7491"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10913","display_name":"Molecular Junctions and Nanostructures","score":0.9994999766349792,"subfield":{"id":"https://openalex.org/subfields/2208","display_name":"Electrical and Electronic Engineering"},"field":{"id":"https://openalex.org/fields/22","display_name":"Engineering"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},"topics":[{"id":"https://openalex.org/T10913","display_name":"Molecular Junctions and Nanostructures","score":0.9994999766349792,"subfield":{"id":"https://openalex.org/subfields/2208","display_name":"Electrical and Electronic Engineering"},"field":{"id":"https://openalex.org/fields/22","display_name":"Engineering"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T10440","display_name":"Advanced Thermoelectric Materials and Devices","score":0.00019999999494757503,"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/T12285","display_name":"Surface Chemistry and Catalysis","score":0.0,"subfield":{"id":"https://openalex.org/subfields/1606","display_name":"Physical and Theoretical Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/single-molecule-junctions","display_name":"single-molecule junctions","score":0.8009999990463257},{"id":"https://openalex.org/keywords/thermoelectric-properties","display_name":"thermoelectric properties","score":0.7599999904632568},{"id":"https://openalex.org/keywords/seebeck-coefficient","display_name":"Seebeck coefficient","score":0.8709999918937683},{"id":"https://openalex.org/keywords/quantum-interference","display_name":"quantum interference","score":0.9240000247955322},{"id":"https://openalex.org/keywords/contact-effects","display_name":"contact effects","score":0.6290000081062317},{"id":"https://openalex.org/keywords/anchor-groups","display_name":"anchor groups","score":0.9079999923706055},{"id":"https://openalex.org/keywords/gold-electrode","display_name":"gold electrode","score":0.7950000166893005},{"id":"https://openalex.org/keywords/platinum-electrode","display_name":"platinum electrode","score":0.9980000257492065},{"id":"https://openalex.org/keywords/single-molecule-conductance","display_name":"molecular conductance","score":0.7649999856948853},{"id":"https://openalex.org/keywords/coherent-transport","display_name":"coherent transport","score":0.6759999990463257},{"id":"https://openalex.org/keywords/fermi-level-alignment","display_name":"Fermi level alignment","score":0.9309999942779541},{"id":"https://openalex.org/keywords/thermoelectric-generators","display_name":"thermoelectric generators","score":0.902999997138977}],"concepts":[{"id":"https://openalex.org/C63024428","wikidata":"https://www.wikidata.org/wiki/Q552456","display_name":"Thermoelectric effect","level":2,"score":0.8369196057319641},{"id":"https://openalex.org/C112625512","wikidata":"https://www.wikidata.org/wiki/Q1091448","display_name":"Seebeck coefficient","level":3,"score":0.6505128145217896},{"id":"https://openalex.org/C2779563022","wikidata":"https://www.wikidata.org/wiki/Q422152","display_name":"Anthracene","level":2,"score":0.5864772796630859},{"id":"https://openalex.org/C32909587","wikidata":"https://www.wikidata.org/wiki/Q11369","display_name":"Molecule","level":2,"score":0.5834970474243164},{"id":"https://openalex.org/C17525397","wikidata":"https://www.wikidata.org/wiki/Q176140","display_name":"Electrode","level":2,"score":0.5063225030899048},{"id":"https://openalex.org/C117127486","wikidata":"https://www.wikidata.org/wiki/Q11569191","display_name":"Thermoelectric generator","level":3,"score":0.5009362697601318},{"id":"https://openalex.org/C14158195","wikidata":"https://www.wikidata.org/wiki/Q899637","display_name":"HOMO/LUMO","level":3,"score":0.4981074333190918},{"id":"https://openalex.org/C192562407","wikidata":"https://www.wikidata.org/wiki/Q228736","display_name":"Materials science","level":0,"score":0.48457181453704834},{"id":"https://openalex.org/C139358910","wikidata":"https://www.wikidata.org/wiki/Q725417","display_name":"Molecular orbital","level":3,"score":0.47445663809776306},{"id":"https://openalex.org/C121932024","wikidata":"https://www.wikidata.org/wiki/Q5159376","display_name":"Conductance","level":2,"score":0.45909106731414795},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.41108641028404236},{"id":"https://openalex.org/C159467904","wikidata":"https://www.wikidata.org/wiki/Q2001702","display_name":"Chemical physics","level":1,"score":0.39241617918014526},{"id":"https://openalex.org/C26873012","wikidata":"https://www.wikidata.org/wiki/Q214781","display_name":"Condensed matter physics","level":1,"score":0.32679763436317444},{"id":"https://openalex.org/C121332964","wikidata":"https://www.wikidata.org/wiki/Q413","display_name":"Physics","level":0,"score":0.13467055559158325},{"id":"https://openalex.org/C147789679","wikidata":"https://www.wikidata.org/wiki/Q11372","display_name":"Physical chemistry","level":1,"score":0.10194948315620422},{"id":"https://openalex.org/C75473681","wikidata":"https://www.wikidata.org/wiki/Q188651","display_name":"Photochemistry","level":1,"score":0.0745699405670166},{"id":"https://openalex.org/C62520636","wikidata":"https://www.wikidata.org/wiki/Q944","display_name":"Quantum mechanics","level":1,"score":0.070850670337677},{"id":"https://openalex.org/C178790620","wikidata":"https://www.wikidata.org/wiki/Q11351","display_name":"Organic chemistry","level":1,"score":0.05979374051094055}],"mesh":[],"locations_count":10,"locations":[{"id":"doi:10.1021/acs.jpcc.3c00069","doi":"https://doi.org/10.1021/acs.jpcc.3c00069","is_oa":true,"landing_page_url":"https://doi.org/10.1021/acs.jpcc.3c00069","pdf_url":"https://pubs.acs.org/doi/pdf/10.1021/acs.jpcc.3c00069","source":{"id":"https://openalex.org/S95739953","display_name":"The Journal of Physical Chemistry C","issn_l":"1932-7447","issn":["1932-7447","1932-7455"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-c","jufo-2","ki-jl-1","norway-1","poland-140","russia-white-list-1","vabb-shw"],"host_organization":"https://openalex.org/P4310320006","host_organization_name":"American Chemical Society","host_organization_lineage":["https://openalex.org/P4310320006"],"host_organization_lineage_names":["American Chemical Society"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"The Journal of Physical Chemistry C","raw_type":"journal-article"},{"id":"pmh:oai:pubmedcentral.nih.gov:10123663","doi":null,"is_oa":true,"landing_page_url":"https://www.ncbi.nlm.nih.gov/pmc/articles/10123663","pdf_url":"https://pmc.ncbi.nlm.nih.gov/articles/PMC10123663/pdf/jp3c00069.pdf","source":{"id":"https://openalex.org/S2764455111","display_name":"PubMed Central","issn_l":null,"issn":null,"is_oa":true,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":"https://openalex.org/I1299303238","host_organization_name":"National Institutes of Health","host_organization_lineage":["https://openalex.org/I1299303238"],"host_organization_lineage_names":[],"type":"repository"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"J Phys Chem C Nanomater Interfaces","raw_type":"Text"},{"id":"pmid:37113454","doi":null,"is_oa":false,"landing_page_url":"https://pubmed.ncbi.nlm.nih.gov/37113454","pdf_url":null,"source":{"id":"https://openalex.org/S4306525036","display_name":"PubMed","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":"https://openalex.org/I1299303238","host_organization_name":"National Institutes of Health","host_organization_lineage":["https://openalex.org/I1299303238"],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"The journal of physical chemistry. C, Nanomaterials and interfaces","raw_type":"Journal Article"},{"id":"pmh:oai:pure.atira.dk:openaire/46a3cddc-3b84-43bb-93df-a29873445bd1","doi":null,"is_oa":true,"landing_page_url":"https://research.birmingham.ac.uk/en/publications/46a3cddc-3b84-43bb-93df-a29873445bd1","pdf_url":null,"source":{"id":"https://openalex.org/S4306402634","display_name":"University of Birmingham Research Portal (University of Birmingham)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":"https://openalex.org/I79619799","host_organization_name":"University of Birmingham","host_organization_lineage":["https://openalex.org/I79619799"],"host_organization_lineage_names":[],"type":"repository"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Hamill, J M, Ismael, A, Al-Jobory, A, Bennett, T L R, Alshahrani, M, Wang, X, Akers-Douglas, M, Wilkinson, L A, Robinson, B J, Long, N J, Lambert, C & Albrecht, T 2023, 'Quantum Interference and Contact Effects in the Thermoelectric Performance of Anthracene-Based Molecules', Journal of Physical Chemistry C, vol. 127, no. 15, pp. 7484-7491. https://doi.org/10.1021/acs.jpcc.3c00069","raw_type":"info:eu-repo/semantics/article"},{"id":"pmh:oai:arXiv.org:2210.17232","doi":null,"is_oa":true,"landing_page_url":"http://arxiv.org/abs/2210.17232","pdf_url":"https://arxiv.org/pdf/2210.17232","source":{"id":"https://openalex.org/S4306400194","display_name":"arXiv (Cornell University)","issn_l":"2331-8422","issn":["2331-8422"],"is_oa":true,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":"https://openalex.org/I205783295","host_organization_name":"Cornell University","host_organization_lineage":["https://openalex.org/I205783295"],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":null,"raw_type":"text"},{"id":"pmh:oai:eprints.whiterose.ac.uk:198142","doi":null,"is_oa":true,"landing_page_url":"https://eprints.whiterose.ac.uk/id/eprint/198142/1/acs.jpcc.3c00069.pdf","pdf_url":"https://eprints.whiterose.ac.uk/id/eprint/198142/1/acs.jpcc.3c00069.pdf","source":{"id":"https://openalex.org/S4306400854","display_name":"White Rose Research Online (University of Leeds, The University of Sheffield, University of York)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":"https://openalex.org/I2800616092","host_organization_name":"White Rose University Consortium","host_organization_lineage":["https://openalex.org/I2800616092"],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":null,"raw_type":"Article"},{"id":"pmh:oai:orbi.ulg.ac.be:2268/343538","doi":null,"is_oa":true,"landing_page_url":"https://orbi.uliege.be/handle/2268/343538","pdf_url":"https://orbi.uliege.be/bitstream/2268/343538/1/Hamill2023.pdf","source":{"id":"https://openalex.org/S4306400651","display_name":"Open Repository and Bibliography (University of Li\u00e8ge)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":"https://openalex.org/I157674565","host_organization_name":"University of Li\u00e8ge","host_organization_lineage":["https://openalex.org/I157674565"],"host_organization_lineage_names":[],"type":"repository"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"Journal of Physical Chemistry. C, Nanomaterials and interfaces, 127 (15), 7484\u20137491 (2023-04)","raw_type":"http://purl.org/coar/resource_type/c_6501"},{"id":"pmh:oai:eprints.lancs.ac.uk:191437","doi":null,"is_oa":false,"landing_page_url":"https://eprints.lancs.ac.uk/id/eprint/191437/","pdf_url":null,"source":{"id":"https://openalex.org/S4306401916","display_name":"Lancaster EPrints (Lancaster University)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":"https://openalex.org/I67415387","host_organization_name":"Lancaster University","host_organization_lineage":["https://openalex.org/I67415387"],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":null,"raw_type":"Journal Article"},{"id":"pmh:oai:pure.atira.dk:openaire/12943350-66f3-4d83-ae9a-8953a17f2be8","doi":null,"is_oa":true,"landing_page_url":"https://research.edgehill.ac.uk/en/publications/12943350-66f3-4d83-ae9a-8953a17f2be8","pdf_url":null,"source":{"id":"https://openalex.org/S4306402462","display_name":"Edge Hill University Research Information Repository (Edge Hill University)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":"https://openalex.org/I165525304","host_organization_name":"Edge Hill University","host_organization_lineage":["https://openalex.org/I165525304"],"host_organization_lineage_names":[],"type":"repository"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"Hamill, J M, Ismael, A, Al-Jobory, A, Bennett, T L R, Alshahrani, M, Wang, X, Akers-Douglas, M, Wilkinson, L A, Robinson, B J, Long, N J, Lambert, C & Albrecht, T 2023, 'Quantum Interference and Contact Effects in the Thermoelectric Performance of Anthracene-Based Molecules', Journal of Physical Chemistry C, vol. 127, no. 15, pp. 7484-7491. https://doi.org/10.1021/acs.jpcc.3c00069","raw_type":"info:eu-repo/semantics/article"},{"id":"doi:10.48550/arxiv.2210.17232","doi":"https://doi.org/10.48550/arxiv.2210.17232","is_oa":true,"landing_page_url":"https://doi.org/10.48550/arxiv.2210.17232","pdf_url":null,"source":{"id":"https://openalex.org/S4306400194","display_name":"arXiv (Cornell University)","issn_l":"2331-8422","issn":["2331-8422"],"is_oa":true,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":"https://openalex.org/I205783295","host_organization_name":"Cornell University","host_organization_lineage":["https://openalex.org/I205783295"],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":null,"is_accepted":false,"is_published":false,"raw_source_name":null,"raw_type":"Preprint"}],"best_oa_location":{"id":"doi:10.1021/acs.jpcc.3c00069","doi":"https://doi.org/10.1021/acs.jpcc.3c00069","is_oa":true,"landing_page_url":"https://doi.org/10.1021/acs.jpcc.3c00069","pdf_url":"https://pubs.acs.org/doi/pdf/10.1021/acs.jpcc.3c00069","source":{"id":"https://openalex.org/S95739953","display_name":"The Journal of Physical Chemistry C","issn_l":"1932-7447","issn":["1932-7447","1932-7455"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-c","jufo-2","ki-jl-1","norway-1","poland-140","russia-white-list-1","vabb-shw"],"host_organization":"https://openalex.org/P4310320006","host_organization_name":"American Chemical Society","host_organization_lineage":["https://openalex.org/P4310320006"],"host_organization_lineage_names":["American Chemical Society"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"The Journal of Physical Chemistry C","raw_type":"journal-article"},"sustainable_development_goals":[],"study_designs":[],"awards":[{"id":"https://openalex.org/G1109860735","display_name":"Quantum Interference Enhanced Thermoelectricity","funder_award_id":"767187","funder_id":"https://openalex.org/F4320320300","funder_display_name":"European Commission"},{"id":"https://openalex.org/G3991946874","display_name":"Quantum-Interference-Enhanced Thermoelectricity (QUIET).","funder_award_id":"EP/N03337X/1","funder_id":"https://openalex.org/F4320334627","funder_display_name":"Engineering and Physical Sciences Research Council"},{"id":"https://openalex.org/G4549180172","display_name":"Supramolecular Nanorings for Exploring Quantum Interference","funder_award_id":"EP/M014452/1","funder_id":"https://openalex.org/F4320334627","funder_display_name":"Engineering and Physical Sciences Research Council"},{"id":"https://openalex.org/G4558595753","display_name":null,"funder_award_id":"ECF-2020-638","funder_id":"https://openalex.org/F4320319993","funder_display_name":"Leverhulme Trust"},{"id":"https://openalex.org/G5355106276","display_name":null,"funder_award_id":"EP/N03337X/","funder_id":"https://openalex.org/F4320334627","funder_display_name":"Engineering and Physical Sciences Research Council"},{"id":"https://openalex.org/G5392189390","display_name":null,"funder_award_id":"EP/N03337X/2","funder_id":"https://openalex.org/F4320334627","funder_display_name":"Engineering and Physical Sciences Research Council"},{"id":"https://openalex.org/G5475462528","display_name":null,"funder_award_id":"EP/P027156/","funder_id":"https://openalex.org/F4320334627","funder_display_name":"Engineering and Physical Sciences Research Council"},{"id":"https://openalex.org/G6829929474","display_name":null,"funder_award_id":"767187","funder_id":"https://openalex.org/F4320334627","funder_display_name":"Engineering and Physical Sciences Research Council"},{"id":"https://openalex.org/G8188190479","display_name":"Self-assembled molecular monolayers with ultra-low thermal conductance for energy harvesting (QSAMs)","funder_award_id":"EP/P027156/1","funder_id":"https://openalex.org/F4320334627","funder_display_name":"Engineering and Physical Sciences Research Council"},{"id":"https://openalex.org/G8414921593","display_name":"Quantum Interference Enhanced Thermoelectricity","funder_award_id":"767187","funder_id":"https://openalex.org/F4320338336","funder_display_name":"H2020 Future and Emerging Technologies"}],"funders":[{"id":"https://openalex.org/F4320317956","display_name":"Tikrit University","ror":"https://ror.org/01zfzax10"},{"id":"https://openalex.org/F4320318813","display_name":"University of Anbar","ror":"https://ror.org/055a6gk50"},{"id":"https://openalex.org/F4320319621","display_name":"University of Bisha","ror":"https://ror.org/040548g92"},{"id":"https://openalex.org/F4320319993","display_name":"Leverhulme Trust","ror":"https://ror.org/012mzw131"},{"id":"https://openalex.org/F4320320300","display_name":"European Commission","ror":"https://ror.org/00k4n6c32"},{"id":"https://openalex.org/F4320327296","display_name":"Ministry of Education \u2013 Kingdom of Saudi Arabi","ror":"https://ror.org/00q919b81"},{"id":"https://openalex.org/F4320334627","display_name":"Engineering and Physical Sciences Research Council","ror":"https://ror.org/0439y7842"},{"id":"https://openalex.org/F4320338336","display_name":"H2020 Future and Emerging Technologies","ror":null}],"has_content":{"pdf":true,"grobid_xml":true},"content_urls":{"pdf":"https://content.openalex.org/works/W4362736795.pdf","grobid_xml":"https://content.openalex.org/works/W4362736795.grobid-xml"},"referenced_works_count":39,"referenced_works":["https://openalex.org/W1968272203","https://openalex.org/W2004732761","https://openalex.org/W2005143253","https://openalex.org/W2011965173","https://openalex.org/W2013885170","https://openalex.org/W2023426659","https://openalex.org/W2037051654","https://openalex.org/W2059102527","https://openalex.org/W2083397500","https://openalex.org/W2097703203","https://openalex.org/W2101292319","https://openalex.org/W2104198521","https://openalex.org/W2141704677","https://openalex.org/W2317947922","https://openalex.org/W2344472778","https://openalex.org/W2410003901","https://openalex.org/W2513243410","https://openalex.org/W2529704063","https://openalex.org/W2593900384","https://openalex.org/W2594206799","https://openalex.org/W2767382721","https://openalex.org/W2964431508","https://openalex.org/W2979224293","https://openalex.org/W2995847962","https://openalex.org/W2996304641","https://openalex.org/W3011403543","https://openalex.org/W3017841828","https://openalex.org/W3036410348","https://openalex.org/W3047071526","https://openalex.org/W3134744912","https://openalex.org/W3138080279","https://openalex.org/W3183281282","https://openalex.org/W3191451717","https://openalex.org/W3206461035","https://openalex.org/W3212573093","https://openalex.org/W3213211563","https://openalex.org/W4225365660","https://openalex.org/W4282914663","https://openalex.org/W4287965154"],"related_works":["https://openalex.org/W4307933670","https://openalex.org/W3195271244","https://openalex.org/W7154094592","https://openalex.org/W7171339920","https://openalex.org/W2886227842","https://openalex.org/W2184411966","https://openalex.org/W3159457564","https://openalex.org/W7124120741","https://openalex.org/W2799502740","https://openalex.org/W3201636595"],"abstract_inverted_index":{"We":[0],"report":[1],"on":[2,43],"the":[3,32,44,48,78,81,102,112,129,132,134,141,145,151,158,163,171],"single-molecule":[4],"electronic":[5],"and":[6,27,47,53,60,72,160,180],"thermoelectric":[7,142,174,186],"properties":[8],"of":[9,18,34,50,80,119,144,153,162,173],"strategically":[10],"chosen":[11],"anthracene-based":[12],"molecules":[13],"with":[14,69,95],"anchor":[15,36,120,136],"groups":[16,121],"capable":[17],"binding":[19],"to":[20,114,128,139],"noble":[21],"metal":[22],"substrates,":[23],"such":[24],"as":[25,38,40],"gold":[26],"platinum.":[28],"Specifically,":[29],"we":[30],"study":[31],"effect":[33],"different":[35],"groups,":[37],"well":[39],"quantum":[41],"interference,":[42],"electric":[45],"conductance":[46],"thermopower":[49],"gold/single-molecule/gold":[51],"junctions":[52,64],"generally":[54],"find":[55],"good":[56],"agreement":[57,94],"between":[58],"theory":[59],"experiments.":[61],"All":[62],"molecular":[63,84,87,105,146],"display":[65],"transport":[66,71],"characteristics":[67],"consistent":[68],"coherent":[70],"a":[73],"Fermi":[74],"alignment":[75],"approximately":[76],"in":[77,93],"middle":[79],"highest":[82],"occupied":[83],"orbital/lowest":[85],"unoccupied":[86],"orbital":[88],"gap.":[89],"Single-molecule":[90],"results":[91],"are":[92,183],"previously":[96],"reported":[97],"thin-film":[98],"data,":[99],"further":[100],"supporting":[101],"notion":[103],"that":[104],"design":[106,172],"considerations":[107],"may":[108],"be":[109],"translated":[110],"from":[111],"single-":[113],"many-molecule":[115],"devices.":[116],"For":[117,148],"combinations":[118],"where":[122,177],"one":[123],"binds":[124],"significantly":[125],"more":[126],"strongly":[127],"electrodes":[130],"than":[131],"other,":[133],"stronger":[135],"group":[137],"appears":[138],"dominate":[140],"behavior":[143],"junction.":[147],"other":[149],"combinations,":[150],"choice":[152],"electrode":[154],"material":[155],"can":[156],"determine":[157],"sign":[159],"magnitude":[161],"thermopower.":[164],"This":[165],"finding":[166],"has":[167],"important":[168],"implications":[169],"for":[170,185],"generator":[175],"devices,":[176],"both":[178],"n-":[179],"p-type":[181],"conductors":[182],"required":[184],"current":[187],"generation.":[188]},"counts_by_year":[{"year":2026,"cited_by_count":4},{"year":2025,"cited_by_count":13},{"year":2024,"cited_by_count":5},{"year":2023,"cited_by_count":3}],"updated_date":"2026-11-06T12:05:46.655746","created_date":"2023-04-11T00:00:00"}