{"id":"https://openalex.org/W160879964","doi":"https://doi.org/10.1016/j.saa.2003.11.011","title":"Fourier transform infrared and Raman spectra","display_name":"Fourier transform infrared and Raman spectra","publication_year":2004,"publication_date":"2004-04-09","ids":{"openalex":"https://openalex.org/W160879964","doi":"https://doi.org/10.1016/j.saa.2003.11.011","mag":"160879964","pmid":"https://pubmed.ncbi.nlm.nih.gov/15249001"},"language":"en","primary_location":{"id":"doi:10.1016/j.saa.2003.11.011","doi":"https://doi.org/10.1016/j.saa.2003.11.011","is_oa":false,"landing_page_url":"https://doi.org/10.1016/j.saa.2003.11.011","pdf_url":null,"source":{"id":"https://openalex.org/S96873385","display_name":"Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy","issn_l":"1386-1425","issn":["1386-1425","1873-3557"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-a","jufo-1","medline","norway-1","poland-140","russia-white-list-1","vabb-shw"],"host_organization":"https://openalex.org/P4310320990","host_organization_name":"Elsevier BV","host_organization_lineage":["https://openalex.org/P4310320990"],"host_organization_lineage_names":["Elsevier BV"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy","raw_type":"journal-article"},"volume":null,"type":"article","is_traditional":true,"indexed_in":["crossref","pubmed"],"open_access":{"is_oa":false,"oa_status":"closed","oa_url":null,"any_repository_has_fulltext":false},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5111542851","display_name":"Claudio A. T\u00e9llez S.","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I161127581","display_name":"Universidade Federal Fluminense","ror":"https://ror.org/02rjhbb08","country_code":"BR","type":"education","lineage":["https://openalex.org/I161127581"]}],"countries":["BR"],"is_corresponding":true,"raw_author_name":"Claudio A T\u00e9llez S","raw_affiliation_strings":["Departamento de F\u0131\u0301sico-Qu\u0131\u0301mica, Instituto de Qu\u0131\u0301mica, Universidade Federal Fluminense (UFF), Morro do Valonguinho s/n, Niter\u00f3i-Centro, CEP: 24210-150, Rio de Janeiro-RJ, Brazil"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Departamento de F\u0131\u0301sico-Qu\u0131\u0301mica, Instituto de Qu\u0131\u0301mica, Universidade Federal Fluminense (UFF), Morro do Valonguinho s/n, Niter\u00f3i-Centro, CEP: 24210-150, Rio de Janeiro-RJ, Brazil","institution_ids":["https://openalex.org/I161127581"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5078289693","display_name":"Eduardo Hollauer","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I161127581","display_name":"Universidade Federal Fluminense","ror":"https://ror.org/02rjhbb08","country_code":"BR","type":"education","lineage":["https://openalex.org/I161127581"]}],"countries":["BR"],"is_corresponding":false,"raw_author_name":"Eduardo Hollauer","raw_affiliation_strings":["Departamento de F\u0131\u0301sico-Qu\u0131\u0301mica, Instituto de Qu\u0131\u0301mica, Universidade Federal Fluminense (UFF), Morro do Valonguinho s/n, Niter\u00f3i-Centro, CEP: 24210-150, Rio de Janeiro-RJ, Brazil"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Departamento de F\u0131\u0301sico-Qu\u0131\u0301mica, Instituto de Qu\u0131\u0301mica, Universidade Federal Fluminense (UFF), Morro do Valonguinho s/n, Niter\u00f3i-Centro, CEP: 24210-150, Rio de Janeiro-RJ, Brazil","institution_ids":["https://openalex.org/I161127581"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5035109731","display_name":"Tiago Giannerini","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I161127581","display_name":"Universidade Federal Fluminense","ror":"https://ror.org/02rjhbb08","country_code":"BR","type":"education","lineage":["https://openalex.org/I161127581"]}],"countries":["BR"],"is_corresponding":false,"raw_author_name":"Tiago Giannerini","raw_affiliation_strings":["Departamento de F\u0131\u0301sico-Qu\u0131\u0301mica, Instituto de Qu\u0131\u0301mica, Universidade Federal Fluminense (UFF), Morro do Valonguinho s/n, Niter\u00f3i-Centro, CEP: 24210-150, Rio de Janeiro-RJ, Brazil"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Departamento de F\u0131\u0301sico-Qu\u0131\u0301mica, Instituto de Qu\u0131\u0301mica, Universidade Federal Fluminense (UFF), Morro do Valonguinho s/n, Niter\u00f3i-Centro, CEP: 24210-150, Rio de Janeiro-RJ, Brazil","institution_ids":["https://openalex.org/I161127581"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5031101610","display_name":"M.I Pais da Silva","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I2699952","display_name":"Pontif\u00edcia Universidade Cat\u00f3lica do Rio de Janeiro","ror":"https://ror.org/01dg47b60","country_code":"BR","type":"education","lineage":["https://openalex.org/I2699952"]}],"countries":["BR"],"is_corresponding":false,"raw_author_name":"M.I Pais da Silva","raw_affiliation_strings":["Departamento de Qu\u0131\u0301mica, Pontificia Universidade Cat\u00f3lica do Rio de Janeiro, PUC-Rio, Rio de Janeiro-Brazil, Brazil"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Departamento de Qu\u0131\u0301mica, Pontificia Universidade Cat\u00f3lica do Rio de Janeiro, PUC-Rio, Rio de Janeiro-Brazil, Brazil","institution_ids":["https://openalex.org/I2699952"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5101634007","display_name":"Maria Antonieta Mondrag\u00f3n","orcid":"https://orcid.org/0000-0001-8548-7804","observed_orcids":["https://orcid.org/0000-0001-8548-7804"]},"institutions":[{"id":"https://openalex.org/I8961855","display_name":"Universidad Nacional Aut\u00f3noma de M\u00e9xico","ror":"https://ror.org/01tmp8f25","country_code":"MX","type":"education","lineage":["https://openalex.org/I8961855"]}],"countries":["MX"],"is_corresponding":false,"raw_author_name":"M.A Mondrag\u00f3n","raw_affiliation_strings":["Departamento de F\u0131\u0301sica Aplicada y Tecnolog\u0131\u0301a Avanzada, Instituto de F\u0131\u0301sica, UNAM, Quer\u00e9taro, Qro. 76001, Mexico"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Departamento de F\u0131\u0301sica Aplicada y Tecnolog\u0131\u0301a Avanzada, Instituto de F\u0131\u0301sica, UNAM, Quer\u00e9taro, Qro. 76001, Mexico","institution_ids":["https://openalex.org/I8961855"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5036076213","display_name":"Rogelio Rodr\u00edguez","orcid":"https://orcid.org/0000-0002-7455-2276","observed_orcids":["https://orcid.org/0000-0002-7455-2276"]},"institutions":[{"id":"https://openalex.org/I8961855","display_name":"Universidad Nacional Aut\u00f3noma de M\u00e9xico","ror":"https://ror.org/01tmp8f25","country_code":"MX","type":"education","lineage":["https://openalex.org/I8961855"]}],"countries":["MX"],"is_corresponding":false,"raw_author_name":"J.R Rodr\u0131\u0301guez T","raw_affiliation_strings":["Departamento de F\u0131\u0301sica Aplicada y Tecnolog\u0131\u0301a Avanzada, Instituto de F\u0131\u0301sica, UNAM, Quer\u00e9taro, Qro. 76001, Mexico"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Departamento de F\u0131\u0301sica Aplicada y Tecnolog\u0131\u0301a Avanzada, Instituto de F\u0131\u0301sica, UNAM, Quer\u00e9taro, Qro. 76001, Mexico","institution_ids":["https://openalex.org/I8961855"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5033425732","display_name":"Victor Manuel Casta\u00f1o","orcid":"https://orcid.org/0000-0002-2983-5293","observed_orcids":["https://orcid.org/0000-0002-2983-5293"]},"institutions":[{"id":"https://openalex.org/I8961855","display_name":"Universidad Nacional Aut\u00f3noma de M\u00e9xico","ror":"https://ror.org/01tmp8f25","country_code":"MX","type":"education","lineage":["https://openalex.org/I8961855"]}],"countries":["MX"],"is_corresponding":false,"raw_author_name":"V.M Casta\u00f1o","raw_affiliation_strings":["Departamento de F\u0131\u0301sica Aplicada y Tecnolog\u0131\u0301a Avanzada, Instituto de F\u0131\u0301sica, UNAM, Quer\u00e9taro, Qro. 76001, Mexico"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Departamento de F\u0131\u0301sica Aplicada y Tecnolog\u0131\u0301a Avanzada, Instituto de F\u0131\u0301sica, UNAM, Quer\u00e9taro, Qro. 76001, Mexico","institution_ids":["https://openalex.org/I8961855"]}]}],"institutions":[],"countries_distinct_count":2,"institutions_distinct_count":3,"corresponding_author_ids":["https://openalex.org/A5111542851"],"corresponding_institution_ids":["https://openalex.org/I161127581"],"apc_list":{"value":3750,"currency":"USD","value_usd":3750},"apc_paid":null,"fwci":0.5723,"has_fulltext":false,"cited_by_count":21,"citation_normalized_percentile":{"value":0.66580395,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":88,"max":98},"biblio":{"volume":"60","issue":"8-9","first_page":"2171","last_page":"2180"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T11324","display_name":"Spectroscopy Techniques in Biomedical and Chemical Research","score":0.39579999446868896,"subfield":{"id":"https://openalex.org/subfields/1304","display_name":"Biophysics"},"field":{"id":"https://openalex.org/fields/13","display_name":"Biochemistry, Genetics and Molecular Biology"},"domain":{"id":"https://openalex.org/domains/1","display_name":"Life Sciences"}},"topics":[{"id":"https://openalex.org/T11324","display_name":"Spectroscopy Techniques in Biomedical and Chemical Research","score":0.39579999446868896,"subfield":{"id":"https://openalex.org/subfields/1304","display_name":"Biophysics"},"field":{"id":"https://openalex.org/fields/13","display_name":"Biochemistry, Genetics and Molecular Biology"},"domain":{"id":"https://openalex.org/domains/1","display_name":"Life Sciences"}},{"id":"https://openalex.org/T11025","display_name":"Nonlinear Optical Materials Research","score":0.26489999890327454,"subfield":{"id":"https://openalex.org/subfields/2504","display_name":"Electronic, Optical and Magnetic Materials"},"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/T11177","display_name":"Spectroscopy and Quantum Chemical Studies","score":0.2556000053882599,"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/vibrational-spectra","display_name":"vibrational spectra","score":0.8159999847412109},{"id":"https://openalex.org/keywords/vibrational-assignment","display_name":"vibrational assignment","score":0.6859999895095825},{"id":"https://openalex.org/keywords/terephthalic-acid","display_name":"terephthalic acid","score":0.8399999737739563},{"id":"https://openalex.org/keywords/semiempirical-methods","display_name":"semiempirical calculations","score":0.7630000114440918},{"id":"https://openalex.org/keywords/am1","display_name":"AM1","score":0.9449999928474426},{"id":"https://openalex.org/keywords/pm3-semi-empirical-method","display_name":"PM3","score":1.0},{"id":"https://openalex.org/keywords/first-principles-calculations","display_name":"first-principles calculations","score":0.8180000185966492},{"id":"https://openalex.org/keywords/b3lyp","display_name":"B3LYP","score":0.9340000152587891},{"id":"https://openalex.org/keywords/mp2","display_name":"MP2","score":0.7039999961853027},{"id":"https://openalex.org/keywords/molecular-geometry","display_name":"molecular geometry","score":0.6380000114440918},{"id":"https://openalex.org/keywords/infrared-spectra","display_name":"infrared spectra","score":0.6259999871253967},{"id":"https://openalex.org/keywords/raman-spectra","display_name":"Raman spectra","score":1.0}],"concepts":[{"id":"https://openalex.org/C40003534","wikidata":"https://www.wikidata.org/wiki/Q862228","display_name":"Raman spectroscopy","level":2,"score":0.8319832682609558},{"id":"https://openalex.org/C2781442258","wikidata":"https://www.wikidata.org/wiki/Q46310","display_name":"Ab initio","level":2,"score":0.7084657549858093},{"id":"https://openalex.org/C158355884","wikidata":"https://www.wikidata.org/wiki/Q11388","display_name":"Infrared","level":2,"score":0.6216014623641968},{"id":"https://openalex.org/C4839761","wikidata":"https://www.wikidata.org/wiki/Q212111","display_name":"Spectral line","level":2,"score":0.6008479595184326},{"id":"https://openalex.org/C153642686","wikidata":"https://www.wikidata.org/wiki/Q70906","display_name":"Infrared spectroscopy","level":2,"score":0.5527028441429138},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.5452930331230164},{"id":"https://openalex.org/C102519508","wikidata":"https://www.wikidata.org/wiki/Q6520159","display_name":"Fourier transform","level":2,"score":0.5357189774513245},{"id":"https://openalex.org/C183971685","wikidata":"https://www.wikidata.org/wiki/Q547605","display_name":"Ab initio quantum chemistry methods","level":3,"score":0.5342734456062317},{"id":"https://openalex.org/C113196181","wikidata":"https://www.wikidata.org/wiki/Q485223","display_name":"Analytical Chemistry (journal)","level":2,"score":0.42675572633743286},{"id":"https://openalex.org/C2780330708","wikidata":"https://www.wikidata.org/wiki/Q408984","display_name":"Terephthalic acid","level":3,"score":0.42592373490333557},{"id":"https://openalex.org/C41999313","wikidata":"https://www.wikidata.org/wiki/Q489328","display_name":"Molecular physics","level":1,"score":0.3968239426612854},{"id":"https://openalex.org/C147597530","wikidata":"https://www.wikidata.org/wiki/Q369472","display_name":"Computational chemistry","level":1,"score":0.37339329719543457},{"id":"https://openalex.org/C32909587","wikidata":"https://www.wikidata.org/wiki/Q11369","display_name":"Molecule","level":2,"score":0.21305161714553833},{"id":"https://openalex.org/C121332964","wikidata":"https://www.wikidata.org/wiki/Q413","display_name":"Physics","level":0,"score":0.10991838574409485},{"id":"https://openalex.org/C120665830","wikidata":"https://www.wikidata.org/wiki/Q14620","display_name":"Optics","level":1,"score":0.10906916856765747},{"id":"https://openalex.org/C178790620","wikidata":"https://www.wikidata.org/wiki/Q11351","display_name":"Organic chemistry","level":1,"score":0.06081557273864746},{"id":"https://openalex.org/C119394753","wikidata":"https://www.wikidata.org/wiki/Q188245","display_name":"Polyester","level":2,"score":0.0},{"id":"https://openalex.org/C1276947","wikidata":"https://www.wikidata.org/wiki/Q333","display_name":"Astronomy","level":1,"score":0.0},{"id":"https://openalex.org/C62520636","wikidata":"https://www.wikidata.org/wiki/Q944","display_name":"Quantum mechanics","level":1,"score":0.0}],"mesh":[{"descriptor_ui":"D005583","descriptor_name":"Fourier Analysis","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D010795","descriptor_name":"Phthalic Acids","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":true},{"descriptor_ui":"D013059","descriptor_name":"Spectrum Analysis, Raman","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D015394","descriptor_name":"Molecular Structure","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D017550","descriptor_name":"Spectroscopy, Fourier Transform Infrared","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false}],"locations_count":2,"locations":[{"id":"doi:10.1016/j.saa.2003.11.011","doi":"https://doi.org/10.1016/j.saa.2003.11.011","is_oa":false,"landing_page_url":"https://doi.org/10.1016/j.saa.2003.11.011","pdf_url":null,"source":{"id":"https://openalex.org/S96873385","display_name":"Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy","issn_l":"1386-1425","issn":["1386-1425","1873-3557"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-a","jufo-1","medline","norway-1","poland-140","russia-white-list-1","vabb-shw"],"host_organization":"https://openalex.org/P4310320990","host_organization_name":"Elsevier BV","host_organization_lineage":["https://openalex.org/P4310320990"],"host_organization_lineage_names":["Elsevier BV"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy","raw_type":"journal-article"},{"id":"pmid:15249001","doi":null,"is_oa":false,"landing_page_url":"https://pubmed.ncbi.nlm.nih.gov/15249001","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":"Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy","raw_type":"Comparative Study"}],"best_oa_location":null,"sustainable_development_goals":[],"study_designs":[],"awards":[],"funders":[],"has_content":{"grobid_xml":false,"pdf":false},"content_urls":null,"referenced_works_count":19,"referenced_works":["https://openalex.org/W285749399","https://openalex.org/W1550061415","https://openalex.org/W1968943197","https://openalex.org/W1978857818","https://openalex.org/W1982356449","https://openalex.org/W1982373514","https://openalex.org/W1988972431","https://openalex.org/W1989992165","https://openalex.org/W1998336381","https://openalex.org/W2044940178","https://openalex.org/W2045057082","https://openalex.org/W2065988950","https://openalex.org/W2079201483","https://openalex.org/W2094134296","https://openalex.org/W2110988939","https://openalex.org/W2127336290","https://openalex.org/W2320476949","https://openalex.org/W3022503991","https://openalex.org/W4242001633"],"related_works":["https://openalex.org/W2110988939","https://openalex.org/W1965521836","https://openalex.org/W2047106083","https://openalex.org/W1979957739","https://openalex.org/W2102565640","https://openalex.org/W4249979959","https://openalex.org/W2005073750","https://openalex.org/W2083830092","https://openalex.org/W1965047844","https://openalex.org/W7101186397"],"abstract_inverted_index":null,"counts_by_year":[{"year":2026,"cited_by_count":1},{"year":2023,"cited_by_count":2},{"year":2022,"cited_by_count":2},{"year":2020,"cited_by_count":1},{"year":2016,"cited_by_count":1},{"year":2013,"cited_by_count":1},{"year":2012,"cited_by_count":5}],"updated_date":"2026-10-31T12:09:11.096373","created_date":"2016-06-24T00:00:00"}