{"id":"https://openalex.org/W7219834925","doi":"https://doi.org/10.60527/n3v3-ff45","title":"Hirshfeld surfaces, fingerprints and interaction energies with Crystal Explorer","display_name":"Hirshfeld surfaces, fingerprints and interaction energies with Crystal Explorer","publication_year":2026,"publication_date":"2026-10-01","ids":{"openalex":"https://openalex.org/W7219834925","doi":"https://doi.org/10.60527/n3v3-ff45"},"language":"fr","primary_location":{"id":"doi:10.60527/n3v3-ff45","doi":"https://doi.org/10.60527/n3v3-ff45","is_oa":true,"landing_page_url":"https://doi.org/10.60527/n3v3-ff45","pdf_url":null,"source":{"id":"https://openalex.org/S7407051412","display_name":"Fondation Maison des sciences de l'homme","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":null,"host_organization_name":null,"host_organization_lineage":[],"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":"Audiovisual"},"volume":null,"type":"other","is_traditional":false,"indexed_in":["datacite"],"open_access":{"is_oa":true,"oa_status":"green","oa_url":"https://doi.org/10.60527/n3v3-ff45","any_repository_has_fulltext":true},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5157355655","display_name":"Dylan Jayatilaka","orcid":null,"observed_orcids":[]},"institutions":[],"countries":[],"is_corresponding":true,"raw_author_name":"Jayatilaka, Dylan","raw_affiliation_strings":[],"raw_orcid":null,"affiliations":[]}],"institutions":[],"countries_distinct_count":0,"institutions_distinct_count":0,"corresponding_author_ids":["https://openalex.org/A5157355655"],"corresponding_institution_ids":[],"apc_list":null,"apc_paid":null,"fwci":null,"has_fulltext":false,"cited_by_count":0,"citation_normalized_percentile":null,"cited_by_percentile_year":null,"biblio":{"volume":null,"issue":null,"first_page":null,"last_page":null},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10798","display_name":"Crystallography and molecular interactions","score":0.6137999892234802,"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"}},"topics":[{"id":"https://openalex.org/T10798","display_name":"Crystallography and molecular interactions","score":0.6137999892234802,"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"}},{"id":"https://openalex.org/T10464","display_name":"Crystal structures of chemical compounds","score":0.3693999946117401,"subfield":{"id":"https://openalex.org/subfields/1604","display_name":"Inorganic Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T10002","display_name":"Advanced Chemical Physics Studies","score":0.0032999999821186066,"subfield":{"id":"https://openalex.org/subfields/3107","display_name":"Atomic and Molecular Physics, and Optics"},"field":{"id":"https://openalex.org/fields/31","display_name":"Physics and Astronomy"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/hirshfeld-surfaces","display_name":"Hirshfeld surfaces","score":0.9850000143051147},{"id":"https://openalex.org/keywords/intermolecular-interaction-energy","display_name":"intermolecular interaction energy","score":0.8579999804496765},{"id":"https://openalex.org/keywords/crystal-structure-analysis","display_name":"crystal structure analysis","score":0.6650000214576721}],"concepts":[{"id":"https://openalex.org/C2781285689","wikidata":"https://www.wikidata.org/wiki/Q21921428","display_name":"Crystal (programming language)","level":2,"score":0.5910000205039978},{"id":"https://openalex.org/C192562407","wikidata":"https://www.wikidata.org/wiki/Q228736","display_name":"Materials science","level":0,"score":0.38449999690055847},{"id":"https://openalex.org/C121332964","wikidata":"https://www.wikidata.org/wiki/Q413","display_name":"Physics","level":0,"score":0.37959998846054077},{"id":"https://openalex.org/C8010536","wikidata":"https://www.wikidata.org/wiki/Q160398","display_name":"Crystallography","level":1,"score":0.37380000948905945},{"id":"https://openalex.org/C115624301","wikidata":"https://www.wikidata.org/wiki/Q895901","display_name":"Crystal structure","level":2,"score":0.36890000104904175},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.2793000042438507},{"id":"https://openalex.org/C2776401178","wikidata":"https://www.wikidata.org/wiki/Q12050496","display_name":"Feature (linguistics)","level":2,"score":0.25270000100135803},{"id":"https://openalex.org/C9652623","wikidata":"https://www.wikidata.org/wiki/Q190109","display_name":"Field (mathematics)","level":2,"score":0.24199999868869781},{"id":"https://openalex.org/C4839761","wikidata":"https://www.wikidata.org/wiki/Q212111","display_name":"Spectral line","level":2,"score":0.22769999504089355},{"id":"https://openalex.org/C99498987","wikidata":"https://www.wikidata.org/wiki/Q2210247","display_name":"Noise (video)","level":3,"score":0.22669999301433563}],"mesh":[],"locations_count":1,"locations":[{"id":"doi:10.60527/n3v3-ff45","doi":"https://doi.org/10.60527/n3v3-ff45","is_oa":true,"landing_page_url":"https://doi.org/10.60527/n3v3-ff45","pdf_url":null,"source":{"id":"https://openalex.org/S7407051412","display_name":"Fondation Maison des sciences de l'homme","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":null,"host_organization_name":null,"host_organization_lineage":[],"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":"Audiovisual"}],"best_oa_location":{"id":"doi:10.60527/n3v3-ff45","doi":"https://doi.org/10.60527/n3v3-ff45","is_oa":true,"landing_page_url":"https://doi.org/10.60527/n3v3-ff45","pdf_url":null,"source":{"id":"https://openalex.org/S7407051412","display_name":"Fondation Maison des sciences de l'homme","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":null,"host_organization_name":null,"host_organization_lineage":[],"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":"Audiovisual"},"sustainable_development_goals":[],"study_designs":[],"awards":[],"funders":[],"has_content":{"pdf":false,"grobid_xml":false},"content_urls":null,"referenced_works_count":0,"referenced_works":[],"related_works":["https://openalex.org/W3149818669","https://openalex.org/W4388718321","https://openalex.org/W6931711674","https://openalex.org/W3159829212","https://openalex.org/W2558206048","https://openalex.org/W4327803038","https://openalex.org/W2245627991","https://openalex.org/W4380996363","https://openalex.org/W2013176211","https://openalex.org/W4396799593"],"abstract_inverted_index":null,"counts_by_year":[],"updated_date":"2026-10-06T10:28:23.643775","created_date":"2026-10-05T00:00:00"}
