Anharmonic Aspects in Vibrational Circular Dichroism Spectra from 900 to 9000 cm<sup>–1</sup> for Methyloxirane and Methylthiirane

Name: Work Video:
Duration: 3 min 30 s
Marco Fusè; Giovanna Longhi; Giuseppe Mazzeo; Stefano Stranges; Francesca Leonelli; Giorgia Aquila; Enrico Bodo; Bruno Brunetti; Carlo Bicchi; Cecilia Cagliero; Julien Bloino; Sergio Abbate
{'id': 'https://openalex.org/W4296773469', 'doi': 'https://doi.org/10.1021/acs.jpca.2c05332', 'title': 'Anharmonic Aspects in Vibrational Circular Dichroism Spectra from 900 to 9000 cm<sup>–1</sup> for Methyloxirane and Methylthiirane', 'display_name': 'Anharmonic Aspects in Vibrational Circular Dichroism Spectra from 900 to 9000 cm<sup>–1</sup> for Methyloxirane and Methylthiirane', 'publication_year': 2022, 'publication_date': '2022-09-20', 'ids': {'openalex': 'https://openalex.org/W4296773469', 'doi': 'https://doi.org/10.1021/acs.jpca.2c05332', 'pmid': 'https://pubmed.ncbi.nlm.nih.gov/36126273'}, 'language': 'en', 'primary_location': {'is_oa': True, 'landing_page_url': 'https://doi.org/10.1021/acs.jpca.2c05332', 'pdf_url': 'https://pubs.acs.org/doi/pdf/10.1021/acs.jpca.2c05332', 'source': {'id': 'https://openalex.org/S146709414', 'display_name': 'The Journal of Physical Chemistry A', 'issn_l': '1089-5639', 'issn': ['1089-5639', '1520-5215'], 'is_oa': False, 'is_in_doaj': False, 'is_core': True, '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}, 'type': 'article', 'type_crossref': 'journal-article', 'indexed_in': ['crossref', 'pubmed'], 'open_access': {'is_oa': True, 'oa_status': 'hybrid', 'oa_url': 'https://pubs.acs.org/doi/pdf/10.1021/acs.jpca.2c05332', 'any_repository_has_fulltext': True}, 'authorships': [{'author_position': 'first', 'author': {'id': 'https://openalex.org/A5056228692', 'display_name': 'Marco Fusè', 'orcid': 'https://orcid.org/0000-0003-0130-5175'}, 'institutions': [{'id': 'https://openalex.org/I79940851', 'display_name': 'University of Brescia', 'ror': 'https://ror.org/02q2d2610', 'country_code': 'IT', 'type': 'education', 'lineage': ['https://openalex.org/I79940851']}], 'countries': ['IT'], 'is_corresponding': False, 'raw_author_name': 'Marco Fusè', 'raw_affiliation_strings': ['Dipartimento di Medicina Molecolare e Traslazionale, Università di Brescia, Viale Europa 11, 25123 Brescia, Italy'], 'affiliations': [{'raw_affiliation_string': 'Dipartimento di Medicina Molecolare e Traslazionale, Università di Brescia, Viale Europa 11, 25123 Brescia, Italy', 'institution_ids': ['https://openalex.org/I79940851']}]}, {'author_position': 'middle', 'author': {'id': 'https://openalex.org/A5021167246', 'display_name': 'Giovanna Longhi', 'orcid': 'https://orcid.org/0000-0002-0011-5946'}, 'institutions': [{'id': 'https://openalex.org/I79940851', 'display_name': 'University of Brescia', 'ror': 'https://ror.org/02q2d2610', 'country_code': 'IT', 'type': 'education', 'lineage': ['https://openalex.org/I79940851']}, {'id': 'https://openalex.org/I4210120496', 'display_name': 'Istituto Nazionale di Ottica', 'ror': 'https://ror.org/02dp3a879', 'country_code': 'IT', 'type': 'facility', 'lineage': ['https://openalex.org/I4210120496', 'https://openalex.org/I4210155236']}], 'countries': ['IT'], 'is_corresponding': False, 'raw_author_name': 'Giovanna Longhi', 'raw_affiliation_strings': ['Dipartimento di Medicina Molecolare e Traslazionale, Università di Brescia, Viale Europa 11, 25123 Brescia, Italy', 'Istituto Nazionale di Ottica (INO), CNR, Research Unit of Brescia, c/o CSMT, VIA Branze 45, 25123 Brescia, Italy'], 'affiliations': [{'raw_affiliation_string': 'Dipartimento di Medicina Molecolare e Traslazionale, Università di Brescia, Viale Europa 11, 25123 Brescia, Italy', 'institution_ids': ['https://openalex.org/I79940851']}, {'raw_affiliation_string': 'Istituto Nazionale di Ottica (INO), CNR, Research Unit of Brescia, c/o CSMT, VIA Branze 45, 25123 Brescia, Italy', 'institution_ids': ['https://openalex.org/I4210120496']}]}, {'author_position': 'middle', 'author': {'id': 'https://openalex.org/A5070815901', 'display_name': 'Giuseppe Mazzeo', 'orcid': 'https://orcid.org/0000-0002-3819-6438'}, 'institutions': [{'id': 'https://openalex.org/I79940851', 'display_name': 'University of Brescia', 'ror': 'https://ror.org/02q2d2610', 'country_code': 'IT', 'type': 'education', 'lineage': ['https://openalex.org/I79940851']}], 'countries': ['IT'], 'is_corresponding': False, 'raw_author_name': 'Giuseppe Mazzeo', 'raw_affiliation_strings': ['Dipartimento di Medicina Molecolare e Traslazionale, Università di Brescia, Viale Europa 11, 25123 Brescia, Italy'], 'affiliations': [{'raw_affiliation_string': 'Dipartimento di Medicina Molecolare e Traslazionale, Università di Brescia, Viale Europa 11, 25123 Brescia, Italy', 'institution_ids': ['https://openalex.org/I79940851']}]}, {'author_position': 'middle', 'author': {'id': 'https://openalex.org/A5070778699', 'display_name': 'Stefano Stranges', 'orcid': 'https://orcid.org/0000-0002-9057-5072'}, 'institutions': [{'id': 'https://openalex.org/I861853513', 'display_name': 'Sapienza University of Rome', 'ror': 'https://ror.org/02be6w209', 'country_code': 'IT', 'type': 'education', 'lineage': ['https://openalex.org/I861853513']}, {'id': 'https://openalex.org/I2801626668', 'display_name': 'AREA Science Park', 'ror': 'https://ror.org/01dt7qh15', 'country_code': 'IT', 'type': 'archive', 'lineage': ['https://openalex.org/I2801626668']}], 'countries': ['IT'], 'is_corresponding': False, 'raw_author_name': 'Stefano Stranges', 'raw_affiliation_strings': ['Dipartimento di Chimica e Tecnologia del Farmaco, Università“La Sapienza”, P.le A. Moro 5, 00185 Roma, Italy', 'IOM-CNR, Laboratorio TASC, Basovizza, 34149 Trieste, Italy'], 'affiliations': [{'raw_affiliation_string': 'Dipartimento di Chimica e Tecnologia del Farmaco, Università“La Sapienza”, P.le A. Moro 5, 00185 Roma, Italy', 'institution_ids': ['https://openalex.org/I861853513']}, {'raw_affiliation_string': 'IOM-CNR, Laboratorio TASC, Basovizza, 34149 Trieste, Italy', 'institution_ids': ['https://openalex.org/I2801626668']}]}, {'author_position': 'middle', 'author': {'id': 'https://openalex.org/A5038291061', 'display_name': 'Francesca Leonelli', 'orcid': 'https://orcid.org/0000-0002-4135-5727'}, 'institutions': [{'id': 'https://openalex.org/I861853513', 'display_name': 'Sapienza University of Rome', 'ror': 'https://ror.org/02be6w209', 'country_code': 'IT', 'type': 'education', 'lineage': ['https://openalex.org/I861853513']}], 'countries': ['IT'], 'is_corresponding': False, 'raw_author_name': 'Francesca Leonelli', 'raw_affiliation_strings': ['Dipartimento di Chimica, Università“La Sapienza”, P.le A. Moro 5, 00185 Roma, Italy'], 'affiliations': [{'raw_affiliation_string': 'Dipartimento di Chimica, Università“La Sapienza”, P.le A. Moro 5, 00185 Roma, Italy', 'institution_ids': ['https://openalex.org/I861853513']}]}, {'author_position': 'middle', 'author': {'id': 'https://openalex.org/A5031587423', 'display_name': 'Giorgia Aquila', 'orcid': None}, 'institutions': [{'id': 'https://openalex.org/I861853513', 'display_name': 'Sapienza University of Rome', 'ror': 'https://ror.org/02be6w209', 'country_code': 'IT', 'type': 'education', 'lineage': ['https://openalex.org/I861853513']}], 'countries': ['IT'], 'is_corresponding': False, 'raw_author_name': 'Giorgia Aquila', 'raw_affiliation_strings': ['Dipartimento di Chimica, Università“La Sapienza”, P.le A. Moro 5, 00185 Roma, Italy'], 'affiliations': [{'raw_affiliation_string': 'Dipartimento di Chimica, Università“La Sapienza”, P.le A. Moro 5, 00185 Roma, Italy', 'institution_ids': ['https://openalex.org/I861853513']}]}, {'author_position': 'middle', 'author': {'id': 'https://openalex.org/A5068540710', 'display_name': 'Enrico Bodo', 'orcid': 'https://orcid.org/0000-0001-8449-4711'}, 'institutions': [{'id': 'https://openalex.org/I861853513', 'display_name': 'Sapienza University of Rome', 'ror': 'https://ror.org/02be6w209', 'country_code': 'IT', 'type': 'education', 'lineage': ['https://openalex.org/I861853513']}], 'countries': ['IT'], 'is_corresponding': False, 'raw_author_name': 'Enrico Bodo', 'raw_affiliation_strings': ['Dipartimento di Chimica, Università“La Sapienza”, P.le A. Moro 5, 00185 Roma, Italy'], 'affiliations': [{'raw_affiliation_string': 'Dipartimento di Chimica, Università“La Sapienza”, P.le A. Moro 5, 00185 Roma, Italy', 'institution_ids': ['https://openalex.org/I861853513']}]}, {'author_position': 'middle', 'author': {'id': 'https://openalex.org/A5033117713', 'display_name': 'Bruno Brunetti', 'orcid': 'https://orcid.org/0000-0001-8837-8179'}, 'institutions': [{'id': 'https://openalex.org/I861853513', 'display_name': 'Sapienza University of Rome', 'ror': 'https://ror.org/02be6w209', 'country_code': 'IT', 'type': 'education', 'lineage': ['https://openalex.org/I861853513']}], 'countries': ['IT'], 'is_corresponding': False, 'raw_author_name': 'Bruno Brunetti', 'raw_affiliation_strings': ['ISMN-CNR, Università La Sapienza, P.le A. Moro 5, 00185 Roma, Italy'], 'affiliations': [{'raw_affiliation_string': 'ISMN-CNR, Università La Sapienza, P.le A. Moro 5, 00185 Roma, Italy', 'institution_ids': ['https://openalex.org/I861853513']}]}, {'author_position': 'middle', 'author': {'id': 'https://openalex.org/A5007226151', 'display_name': 'Carlo Bicchi', 'orcid': 'https://orcid.org/0000-0003-1782-7357'}, 'institutions': [{'id': 'https://openalex.org/I55143463', 'display_name': 'University of Turin', 'ror': 'https://ror.org/048tbm396', 'country_code': 'IT', 'type': 'education', 'lineage': ['https://openalex.org/I55143463']}], 'countries': ['IT'], 'is_corresponding': False, 'raw_author_name': 'Carlo Bicchi', 'raw_affiliation_strings': ['Dipartimento di Scienza e Tecnologia del Farmaco, Università degli Studi di Torino, Via Pietro Giuria 9,00124 Torino, Italy'], 'affiliations': [{'raw_affiliation_string': 'Dipartimento di Scienza e Tecnologia del Farmaco, Università degli Studi di Torino, Via Pietro Giuria 9,00124 Torino, Italy', 'institution_ids': ['https://openalex.org/I55143463']}]}, {'author_position': 'middle', 'author': {'id': 'https://openalex.org/A5090399516', 'display_name': 'Cecilia Cagliero', 'orcid': 'https://orcid.org/0000-0003-3512-6124'}, 'institutions': [{'id': 'https://openalex.org/I55143463', 'display_name': 'University of Turin', 'ror': 'https://ror.org/048tbm396', 'country_code': 'IT', 'type': 'education', 'lineage': ['https://openalex.org/I55143463']}], 'countries': ['IT'], 'is_corresponding': False, 'raw_author_name': 'Cecilia Cagliero', 'raw_affiliation_strings': ['Dipartimento di Scienza e Tecnologia del Farmaco, Università degli Studi di Torino, Via Pietro Giuria 9,00124 Torino, Italy'], 'affiliations': [{'raw_affiliation_string': 'Dipartimento di Scienza e Tecnologia del Farmaco, Università degli Studi di Torino, Via Pietro Giuria 9,00124 Torino, Italy', 'institution_ids': ['https://openalex.org/I55143463']}]}, {'author_position': 'middle', 'author': {'id': 'https://openalex.org/A5012931425', 'display_name': 'Julien Bloino', 'orcid': 'https://orcid.org/0000-0003-4245-4695'}, 'institutions': [{'id': 'https://openalex.org/I157210198', 'display_name': 'Scuola Normale Superiore', 'ror': 'https://ror.org/03aydme10', 'country_code': 'IT', 'type': 'education', 'lineage': ['https://openalex.org/I157210198']}], 'countries': ['IT'], 'is_corresponding': True, 'raw_author_name': 'Julien Bloino', 'raw_affiliation_strings': ['Scuola Normale Superiore, Piazza dei Cavalieri, 56125, Pisa, Italy'], 'affiliations': [{'raw_affiliation_string': 'Scuola Normale Superiore, Piazza dei Cavalieri, 56125, Pisa, Italy', 'institution_ids': ['https://openalex.org/I157210198']}]}, {'author_position': 'last', 'author': {'id': 'https://openalex.org/A5088380384', 'display_name': 'Sergio Abbate', 'orcid': 'https://orcid.org/0000-0001-9359-1214'}, 'institutions': [{'id': 'https://openalex.org/I79940851', 'display_name': 'University of Brescia', 'ror': 'https://ror.org/02q2d2610', 'country_code': 'IT', 'type': 'education', 'lineage': ['https://openalex.org/I79940851']}, {'id': 'https://openalex.org/I4210120496', 'display_name': 'Istituto Nazionale di Ottica', 'ror': 'https://ror.org/02dp3a879', 'country_code': 'IT', 'type': 'facility', 'lineage': ['https://openalex.org/I4210120496', 'https://openalex.org/I4210155236']}], 'countries': ['IT'], 'is_corresponding': True, 'raw_author_name': 'Sergio Abbate', 'raw_affiliation_strings': ['Dipartimento di Medicina Molecolare e Traslazionale, Università di Brescia, Viale Europa 11, 25123 Brescia, Italy', 'Istituto Nazionale di Ottica (INO), CNR, Research Unit of Brescia, c/o CSMT, VIA Branze 45, 25123 Brescia, Italy'], 'affiliations': [{'raw_affiliation_string': 'Dipartimento di Medicina Molecolare e Traslazionale, Università di Brescia, Viale Europa 11, 25123 Brescia, Italy', 'institution_ids': ['https://openalex.org/I79940851']}, {'raw_affiliation_string': 'Istituto Nazionale di Ottica (INO), CNR, Research Unit of Brescia, c/o CSMT, VIA Branze 45, 25123 Brescia, Italy', 'institution_ids': ['https://openalex.org/I4210120496']}]}], 'institution_assertions': [], 'countries_distinct_count': 1, 'institutions_distinct_count': 6, 'corresponding_author_ids': ['https://openalex.org/A5012931425', 'https://openalex.org/A5088380384'], 'corresponding_institution_ids': ['https://openalex.org/I157210198', 'https://openalex.org/I79940851', 'https://openalex.org/I4210120496'], 'apc_list': None, 'apc_paid': None, 'fwci': 1.999, 'has_fulltext': True, 'fulltext_origin': 'pdf', 'cited_by_count': 13, 'citation_normalized_percentile': {'value': 0.999769, 'is_in_top_1_percent': True, 'is_in_top_10_percent': True}, 'cited_by_percentile_year': {'min': 93, 'max': 94}, 'biblio': {'volume': '126', 'issue': '38', 'first_page': '6719', 'last_page': '6733'}, 'is_retracted': False, 'is_paratext': False, 'primary_topic': {'id': 'https://openalex.org/T12748', 'display_name': 'Molecular spectroscopy and chirality', 'score': 1.0, 'subfield': {'id': 'https://openalex.org/subfields/1607', 'display_name': 'Spectroscopy'}, '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/T12748', 'display_name': 'Molecular spectroscopy and chirality', 'score': 1.0, 'subfield': {'id': 'https://openalex.org/subfields/1607', 'display_name': 'Spectroscopy'}, '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/T11177', 'display_name': 'Spectroscopy and Quantum Chemical Studies', 'score': 0.9988, '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'}}, {'id': 'https://openalex.org/T10044', 'display_name': 'Protein Structure and Dynamics', 'score': 0.9894, 'subfield': {'id': 'https://openalex.org/subfields/1312', 'display_name': 'Molecular Biology'}, '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'}}], 'keywords': [{'id': 'https://openalex.org/keywords/overtone', 'display_name': 'Overtone', 'score': 0.9395608}, {'id': 'https://openalex.org/keywords/vibrational-circular-dichroism', 'display_name': 'Vibrational Circular Dichroism', 'score': 0.76745796}], 'concepts': [{'id': 'https://openalex.org/C147724859', 'wikidata': 'https://www.wikidata.org/wiki/Q545228', 'display_name': 'Anharmonicity', 'level': 2, 'score': 0.9686874}, {'id': 'https://openalex.org/C38615331', 'wikidata': 'https://www.wikidata.org/wiki/Q261967', 'display_name': 'Overtone', 'level': 3, 'score': 0.9395608}, {'id': 'https://openalex.org/C189010761', 'wikidata': 'https://www.wikidata.org/wiki/Q7924663', 'display_name': 'Vibrational circular dichroism', 'level': 3, 'score': 0.76745796}, {'id': 'https://openalex.org/C4839761', 'wikidata': 'https://www.wikidata.org/wiki/Q212111', 'display_name': 'Spectral line', 'level': 2, 'score': 0.71330506}, {'id': 'https://openalex.org/C185592680', 'wikidata': 'https://www.wikidata.org/wiki/Q2329', 'display_name': 'Chemistry', 'level': 0, 'score': 0.5896499}, {'id': 'https://openalex.org/C24123453', 'wikidata': 'https://www.wikidata.org/wiki/Q900121', 'display_name': 'Molecular vibration', 'level': 3, 'score': 0.51469356}, {'id': 'https://openalex.org/C41999313', 'wikidata': 'https://www.wikidata.org/wiki/Q489328', 'display_name': 'Molecular physics', 'level': 1, 'score': 0.5103101}, {'id': 'https://openalex.org/C133571119', 'wikidata': 'https://www.wikidata.org/wiki/Q899102', 'display_name': 'Circular dichroism', 'level': 2, 'score': 0.4885653}, {'id': 'https://openalex.org/C87210426', 'wikidata': 'https://www.wikidata.org/wiki/Q1072476', 'display_name': 'Bending', 'level': 2, 'score': 0.47121137}, {'id': 'https://openalex.org/C153642686', 'wikidata': 'https://www.wikidata.org/wiki/Q70906', 'display_name': 'Infrared spectroscopy', 'level': 2, 'score': 0.4681568}, {'id': 'https://openalex.org/C125287762', 'wikidata': 'https://www.wikidata.org/wiki/Q1758948', 'display_name': 'Absorption (acoustics)', 'level': 2, 'score': 0.43116617}, {'id': 'https://openalex.org/C119824511', 'wikidata': 'https://www.wikidata.org/wiki/Q13553575', 'display_name': 'Absorption spectroscopy', 'level': 2, 'score': 0.43001246}, {'id': 'https://openalex.org/C32909587', 'wikidata': 'https://www.wikidata.org/wiki/Q11369', 'display_name': 'Molecule', 'level': 2, 'score': 0.42941678}, {'id': 'https://openalex.org/C184779094', 'wikidata': 'https://www.wikidata.org/wiki/Q26383', 'display_name': 'Atomic physics', 'level': 1, 'score': 0.4009271}, {'id': 'https://openalex.org/C121332964', 'wikidata': 'https://www.wikidata.org/wiki/Q413', 'display_name': 'Physics', 'level': 0, 'score': 0.23872867}, {'id': 'https://openalex.org/C120665830', 'wikidata': 'https://www.wikidata.org/wiki/Q14620', 'display_name': 'Optics', 'level': 1, 'score': 0.1989477}, {'id': 'https://openalex.org/C8010536', 'wikidata': 'https://www.wikidata.org/wiki/Q160398', 'display_name': 'Crystallography', 'level': 1, 'score': 0.14184037}, {'id': 'https://openalex.org/C26873012', 'wikidata': 'https://www.wikidata.org/wiki/Q214781', 'display_name': 'Condensed matter physics', 'level': 1, 'score': 0.059792906}, {'id': 'https://openalex.org/C62520636', 'wikidata': 'https://www.wikidata.org/wiki/Q944', 'display_name': 'Quantum mechanics', 'level': 1, 'score': 0.05509889}, {'id': 'https://openalex.org/C178790620', 'wikidata': 'https://www.wikidata.org/wiki/Q11351', 'display_name': 'Organic chemistry', 'level': 1, 'score': 0.0}, {'id': 'https://openalex.org/C97355855', 'wikidata': 'https://www.wikidata.org/wiki/Q11473', 'display_name': 'Thermodynamics', 'level': 1, 'score': 0.0}], 'mesh': [], 'locations_count': 5, 'locations': [{'is_oa': True, 'landing_page_url': 'https://doi.org/10.1021/acs.jpca.2c05332', 'pdf_url': 'https://pubs.acs.org/doi/pdf/10.1021/acs.jpca.2c05332', 'source': {'id': 'https://openalex.org/S146709414', 'display_name': 'The Journal of Physical Chemistry A', 'issn_l': '1089-5639', 'issn': ['1089-5639', '1520-5215'], 'is_oa': False, 'is_in_doaj': False, 'is_core': True, '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}, {'is_oa': True, 'landing_page_url': 'https://hdl.handle.net/11384/139967', 'pdf_url': 'https://ricerca.sns.it/bitstream/11384/139967/1/fus%25C3%25A8-et-al-2022-anharmonic-aspects-in-vibrational-circular-dichroism-spectra-from-900-to-9000-cm-1-for-methyloxirane.pdf', 'source': None, 'license': 'other-oa', 'license_id': 'https://openalex.org/licenses/other-oa', 'version': 'publishedVersion', 'is_accepted': True, 'is_published': True}, {'is_oa': True, 'landing_page_url': 'https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9527749', 'pdf_url': None, 'source': {'id': 'https://openalex.org/S2764455111', 'display_name': 'PubMed Central', 'issn_l': None, 'issn': None, 'is_oa': True, 'is_in_doaj': False, 'is_core': False, 'host_organization': 'https://openalex.org/I1299303238', 'host_organization_name': 'National Institutes of Health', 'host_organization_lineage': ['https://openalex.org/I1299303238'], 'host_organization_lineage_names': ['National Institutes of Health'], 'type': 'repository'}, 'license': None, 'license_id': None, 'version': 'publishedVersion', 'is_accepted': True, 'is_published': True}, {'is_oa': True, 'landing_page_url': 'https://hdl.handle.net/11573/1655346', 'pdf_url': 'https://iris.uniroma1.it/bitstream/11573/1655346/1/Fus%c3%a9_Anharmonic-aspects_2022.pdf', 'source': {'id': 'https://openalex.org/S4377196107', 'display_name': 'IRIS Research product catalog (Sapienza University of Rome)', 'issn_l': None, 'issn': None, 'is_oa': False, 'is_in_doaj': False, 'is_core': False, 'host_organization': None, 'host_organization_name': None, 'host_organization_lineage': [], 'host_organization_lineage_names': [], 'type': 'repository'}, 'license': 'other-oa', 'license_id': 'https://openalex.org/licenses/other-oa', 'version': 'submittedVersion', 'is_accepted': False, 'is_published': False}, {'is_oa': False, 'landing_page_url': 'https://pubmed.ncbi.nlm.nih.gov/36126273', 'pdf_url': None, 'source': {'id': 'https://openalex.org/S4306525036', 'display_name': 'PubMed', 'issn_l': None, 'issn': None, 'is_oa': False, 'is_in_doaj': False, 'is_core': False, 'host_organization': 'https://openalex.org/I1299303238', 'host_organization_name': 'National Institutes of Health', 'host_organization_lineage': ['https://openalex.org/I1299303238'], 'host_organization_lineage_names': ['National Institutes of Health'], 'type': 'repository'}, 'license': None, 'license_id': None, 'version': None, 'is_accepted': False, 'is_published': False}], 'best_oa_location': {'is_oa': True, 'landing_page_url': 'https://doi.org/10.1021/acs.jpca.2c05332', 'pdf_url': 'https://pubs.acs.org/doi/pdf/10.1021/acs.jpca.2c05332', 'source': {'id': 'https://openalex.org/S146709414', 'display_name': 'The Journal of Physical Chemistry A', 'issn_l': '1089-5639', 'issn': ['1089-5639', '1520-5215'], 'is_oa': False, 'is_in_doaj': False, 'is_core': True, '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}, 'sustainable_development_goals': [], 'grants': [{'funder': 'https://openalex.org/F4320331528', 'funder_display_name': "Ministero dell'Università e della Ricerca", 'award_id': '2020HTSXMA PRIN 2029 "PSI-MOVIE"'}, {'funder': 'https://openalex.org/F4320331528', 'funder_display_name': "Ministero dell'Università e della Ricerca", 'award_id': '2017A4XRCA PRIN 2017 "PHANTOMS"'}], 'datasets': [], 'versions': [], 'referenced_works_count': 70, 'referenced_works': ['https://openalex.org/W1965096205', 'https://openalex.org/W1965564153', 'https://openalex.org/W1976389500', 'https://openalex.org/W1976814018', 'https://openalex.org/W1977801225', 'https://openalex.org/W1983275387', 'https://openalex.org/W1985391085', 'https://openalex.org/W1994334348', 'https://openalex.org/W1996393190', 'https://openalex.org/W1997666756', 'https://openalex.org/W2002477246', 'https://openalex.org/W2003301106', 'https://openalex.org/W2006481877', 'https://openalex.org/W2007995899', 'https://openalex.org/W2008788139', 'https://openalex.org/W2009094433', 'https://openalex.org/W2011301426', 'https://openalex.org/W2023480901', 'https://openalex.org/W2025017695', 'https://openalex.org/W2028041077', 'https://openalex.org/W2031723937', 'https://openalex.org/W2034605346', 'https://openalex.org/W2036465208', 'https://openalex.org/W2038661820', 'https://openalex.org/W2038663016', 'https://openalex.org/W2044105167', 'https://openalex.org/W2044716976', 'https://openalex.org/W2053633298', 'https://openalex.org/W2057881168', 'https://openalex.org/W2063639336', 'https://openalex.org/W2069006374', 'https://openalex.org/W2070780695', 'https://openalex.org/W2071395489', 'https://openalex.org/W2074927834', 'https://openalex.org/W2076356610', 'https://openalex.org/W2079435354', 'https://openalex.org/W2080318735', 'https://openalex.org/W2080914603', 'https://openalex.org/W2081434407', 'https://openalex.org/W2085567242', 'https://openalex.org/W2088304060', 'https://openalex.org/W2094168000', 'https://openalex.org/W2114106656', 'https://openalex.org/W2119270906', 'https://openalex.org/W2128594641', 'https://openalex.org/W2143981217', 'https://openalex.org/W2160665666', 'https://openalex.org/W2171839036', 'https://openalex.org/W2325192612', 'https://openalex.org/W2327394219', 'https://openalex.org/W2328386932', 'https://openalex.org/W2328899588', 'https://openalex.org/W2329958561', 'https://openalex.org/W2334161927', 'https://openalex.org/W2437618352', 'https://openalex.org/W2733878863', 'https://openalex.org/W2913723928', 'https://openalex.org/W2914986629', 'https://openalex.org/W2917690078', 'https://openalex.org/W2947748939', 'https://openalex.org/W2950268431', 'https://openalex.org/W2950360197', 'https://openalex.org/W2979043817', 'https://openalex.org/W2991284114', 'https://openalex.org/W3000250002', 'https://openalex.org/W3005182574', 'https://openalex.org/W3036251603', 'https://openalex.org/W3167083000', 'https://openalex.org/W3197679263', 'https://openalex.org/W4230737148'], 'related_works': ['https://openalex.org/W4387141153', 'https://openalex.org/W4296773469', 'https://openalex.org/W2109932081', 'https://openalex.org/W2070254033', 'https://openalex.org/W2019261388', 'https://openalex.org/W2009638510', 'https://openalex.org/W1987272104', 'https://openalex.org/W1981853356', 'https://openalex.org/W1965286569', 'https://openalex.org/W1557621940'], 'abstract_inverted_index': {'Vibrational': [0], 'circular': [1], 'dichroism': [2], '(VCD)': [3], 'spectra': [4, 9, 44], 'and': [5, 16, 24, 65, 72, 99, 104, 113, 141, 150], 'the': [6, 11, 37, 46, 57, 70, 74, 80, 89, 96, 100, 109, 124, 136], 'corresponding': [7, 58], 'IR': [8, 48], 'of': [10, 14, 17, 79, 91, 102, 111], 'chiral': [12], 'isomers': [13], 'methyloxirane': [15], 'methylthiirane': [18], 'have': [19, 121], 'been': [20, 122], 'reinvestigated,': [21], 'both': [22, 68], 'experimentally': [23], 'theoretically,': [25], 'with': [26, 56, 69, 73], 'particular': [27], 'attention': [28], 'to': [29, 86], 'accounting': [30], 'for': [31], 'anharmonic': [32], 'corrections,': [33], 'as': [34], 'calculated': [35], 'by': [36], 'GVPT2': [38, 71], 'approach.': [39], 'De': [40], 'novo': [41], 'recorded': [42], 'VCD': [43, 112], 'in': [45, 95, 107], 'near': [47], '(NIR)': [49], 'range': [50], 'regarding': [51], 'CH-stretching': [52, 148], 'overtone': [53], 'transitions,': [54, 135], 'together': [55], 'NIR': [59], 'absorption': [60], 'spectra,': [61], 'were': [62], 'also': [63], 'considered': [64], 'accounted': [66], 'for,': [67], 'local': [75], 'mode': [76, 134], 'approaches.': [77], 'Comparison': [78], 'two': [81, 97, 117], 'methods': [82], 'has': [83], 'permitted': [84], 'us': [85], 'better': [87], 'describe': [88], 'nature': [90], 'active': [92], '"anharmonic"': [93], 'modes': [94], 'molecules': [98], 'role': [101], 'mechanical': [103], 'electrical': [105], 'anharmonicity': [106], 'determining': [108], 'intensities': [110], 'IR/NIR': [114, 119], 'data.': [115], 'Finally,': [116], 'nonstandard': [118], 'regions': [120], 'investigated:': [123], 'first': [125], 'one': [126, 138], 'about': [127], '≈2000': [128], 'cm-1,': [129], 'involving': [130, 144], 'mostly': [131], 'two-quanta': [132], 'bending': [133, 152], 'second': [137], 'between': [139], '7000': [140], '7500': [142], 'cm-1': [143], 'three-quanta': [145], 'transitions': [146], 'containing': [147], 'overtones': [149], 'HCC/HCH': [151], 'modes.': [153]}, 'cited_by_api_url': 'https://api.openalex.org/works?filter=cites:W4296773469', 'counts_by_year': [{'year': 2024, 'cited_by_count': 7}, {'year': 2023, 'cited_by_count': 5}, {'year': 2022, 'cited_by_count': 1}], 'updated_date': '2024-12-10T09:11:30.264444', 'created_date': '2022-09-23'}
Publication Information

Basic Information

Access and Citation

AI Researcher Chatbot

Primary Location

Authors

Topics

Keywords

Related Works
