{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,8,24]],"date-time":"2026-08-24T22:41:04Z","timestamp":1787611264971,"version":"build-2736575974"},"reference-count":61,"publisher":"Royal Society of Chemistry (RSC)","issue":"8","license":[{"start":{"date-parts":[[2027,1,22]],"date-time":"2027-01-22T00:00:00Z","timestamp":1800576000000},"content-version":"am","delay-in-days":386,"URL":"http:\/\/rsc.li\/journals-terms-of-use"}],"funder":[{"DOI":"10.13039\/501100001843","name":"Science and Engineering Research Board","doi-asserted-by":"publisher","award":["CRG\/2023\/002306"],"award-info":[{"award-number":["CRG\/2023\/002306"]}],"id":[{"id":"10.13039\/501100001843","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":["rsc.org"],"crossmark-restriction":true},"short-container-title":["Phys. Chem. Chem. Phys."],"abstract":"<jats:p>We present a new implementation to simulate vibronically resolved phosphorescence spectra and the concomitant excited state photophysics of two anti-Kasha molecules that act as single molecule white light emitters (SMWLE).<\/jats:p>","DOI":"10.1039\/d5cp04496k","type":"journal-article","created":{"date-parts":[[2026,1,22]],"date-time":"2026-01-22T11:20:56Z","timestamp":1769080856000},"page":"5408-5417","update-policy":"https:\/\/doi.org\/10.1039\/rsc_crossmark_policy","source":"Crossref","is-referenced-by-count":1,"title":["Addressing vibronic phosphorescence and associated excited state dynamics of anti-Kasha molecules: a time-dependent correlation function approach"],"prefix":"10.1039","volume":"28","author":[{"given":"Keniya","family":"Basu","sequence":"first","affiliation":[{"name":"Department of Chemistry, University of Calcutta, 92 A.P.C Road, Kolkata, 700009, West Bengal, India"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Pijush","family":"Karak","sequence":"additional","affiliation":[{"name":"Department of Chemistry, University of Calcutta, 92 A.P.C Road, Kolkata, 700009, West Bengal, India"},{"name":"Department of Chemistry, KTH Royal Institute of Technology, SE-10044, Stockholm, Sweden"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-1133-0254","authenticated-orcid":false,"given":"Swapan","family":"Chakrabarti","sequence":"additional","affiliation":[{"name":"Department of Chemistry, University of Calcutta, 92 A.P.C Road, Kolkata, 700009, West Bengal, India"}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"292","published-online":{"date-parts":[[2026]]},"reference":[{"key":"D5CP04496K\/cit1\/1","doi-asserted-by":"crossref","first-page":"4893","DOI":"10.1021\/acs.jpclett.7b02148","volume":"8","author":"Paul","year":"2017","journal-title":"J. Phys. Chem. Lett."},{"key":"D5CP04496K\/cit2\/1","doi-asserted-by":"crossref","first-page":"2001685","DOI":"10.1002\/adom.202001685","volume":"9","author":"Liu","year":"2021","journal-title":"Adv. Opt. Mater."},{"key":"D5CP04496K\/cit3\/1","doi-asserted-by":"crossref","first-page":"416","DOI":"10.1038\/s41467-017-00362-5","volume":"8","author":"He","year":"2017","journal-title":"Nat. Commun."},{"key":"D5CP04496K\/cit4\/1","doi-asserted-by":"crossref","first-page":"369","DOI":"10.1021\/acs.jpclett.8b03624","volume":"10","author":"Paul","year":"2019","journal-title":"J. Phys. Chem. Lett."},{"key":"D5CP04496K\/cit5\/1","doi-asserted-by":"crossref","first-page":"24","DOI":"10.1016\/0009-2614(75)85160-8","volume":"32","author":"Chu","year":"1975","journal-title":"Chem. Phys. Lett."},{"key":"D5CP04496K\/cit6\/1","doi-asserted-by":"crossref","first-page":"13449","DOI":"10.1002\/anie.201307601","volume":"52","author":"Chaudhuri","year":"2013","journal-title":"Angew. Chem."},{"key":"D5CP04496K\/cit7\/1","doi-asserted-by":"crossref","first-page":"1802407","DOI":"10.1002\/adfm.201802407","volume":"28","author":"Zhou","year":"2018","journal-title":"Adv. Funct. Mater."},{"key":"D5CP04496K\/cit8\/1","doi-asserted-by":"crossref","first-page":"140974","DOI":"10.1016\/j.cej.2022.140974","volume":"457","author":"Wu","year":"2023","journal-title":"Chem. Eng. J."},{"key":"D5CP04496K\/cit9\/1","doi-asserted-by":"crossref","first-page":"11370","DOI":"10.1002\/anie.201703862","volume":"56","author":"Tu","year":"2017","journal-title":"Angew. Chem., Int. Ed."},{"key":"D5CP04496K\/cit10\/1","doi-asserted-by":"crossref","first-page":"14233","DOI":"10.1021\/acsami.9b20162","volume":"12","author":"Li","year":"2020","journal-title":"ACS Appl. Mater. Interfaces"},{"key":"D5CP04496K\/cit11\/1","doi-asserted-by":"crossref","first-page":"11319","DOI":"10.1002\/chem.202100748","volume":"27","author":"Ajantha","year":"2021","journal-title":"Chem. \u2013 Eur. J."},{"key":"D5CP04496K\/cit12\/1","doi-asserted-by":"crossref","first-page":"101407","DOI":"10.1016\/j.apmt.2022.101407","volume":"27","author":"Behera","year":"2022","journal-title":"Appl. Mater. Today"},{"key":"D5CP04496K\/cit13\/1","doi-asserted-by":"crossref","first-page":"6495","DOI":"10.1038\/s41467-022-34291-9","volume":"13","author":"Wang","year":"2022","journal-title":"Nat. Commun."},{"key":"D5CP04496K\/cit14\/1","doi-asserted-by":"crossref","first-page":"6325","DOI":"10.1021\/ja401769g","volume":"135","author":"Lee","year":"2013","journal-title":"J. Am. Chem. Soc."},{"key":"D5CP04496K\/cit15\/1","doi-asserted-by":"crossref","first-page":"1010","DOI":"10.1021\/jacs.8b11224","volume":"141","author":"Ma","year":"2018","journal-title":"J. Am. Chem. Soc."},{"key":"D5CP04496K\/cit16\/1","doi-asserted-by":"crossref","first-page":"10784","DOI":"10.1039\/D4SC02841D","volume":"15","author":"Tani","year":"2024","journal-title":"Chem. Sci."},{"key":"D5CP04496K\/cit17\/1","doi-asserted-by":"crossref","first-page":"4218","DOI":"10.1002\/adma.201306266","volume":"26","author":"Yook","year":"2014","journal-title":"Adv. Mater."},{"key":"D5CP04496K\/cit18\/1","doi-asserted-by":"crossref","first-page":"35871","DOI":"10.1021\/acsami.9b10870","volume":"11","author":"Wang","year":"2019","journal-title":"ACS Appl. Mater. Interfaces"},{"key":"D5CP04496K\/cit19\/1","doi-asserted-by":"crossref","first-page":"1","DOI":"10.3389\/fsurg.2021.624124","volume":"8","author":"Belykh","year":"2021","journal-title":"Front. Surg."},{"key":"D5CP04496K\/cit20\/1","doi-asserted-by":"crossref","first-page":"29902","DOI":"10.1021\/acsami.8b11663","volume":"10","author":"Kalytchuk","year":"2018","journal-title":"ACS Appl. Mater. Interfaces"},{"key":"D5CP04496K\/cit21\/1","doi-asserted-by":"crossref","first-page":"14","DOI":"10.1039\/df9500900014","volume":"9","author":"Kasha","year":"1950","journal-title":"Discuss. Faraday Soc."},{"key":"D5CP04496K\/cit22\/1","doi-asserted-by":"crossref","first-page":"43","DOI":"10.1016\/S1010-6030(96)04445-0","volume":"100","author":"Maciejewski","year":"1996","journal-title":"J. Photochem. Photobiol."},{"key":"D5CP04496K\/cit23\/1","doi-asserted-by":"crossref","first-page":"125","DOI":"10.1021\/cr60312a003","volume":"78","author":"Turro","year":"1978","journal-title":"Chem. Rev."},{"key":"D5CP04496K\/cit24\/1","doi-asserted-by":"crossref","first-page":"2351","DOI":"10.1021\/cr00039a004","volume":"95","author":"Itoh","year":"1995","journal-title":"Chem. Rev."},{"key":"D5CP04496K\/cit25\/1","doi-asserted-by":"crossref","first-page":"10173","DOI":"10.1002\/anie.202000608","volume":"59","author":"Wu","year":"2020","journal-title":"Angew. Chem., Int. Ed."},{"key":"D5CP04496K\/cit26\/1","doi-asserted-by":"crossref","first-page":"876","DOI":"10.3390\/ijms23020876","volume":"23","author":"Deng","year":"2022","journal-title":"Int. J. Mol. Sci."},{"key":"D5CP04496K\/cit27\/1","doi-asserted-by":"crossref","first-page":"4541","DOI":"10.1021\/cr200166m","volume":"112","author":"Itoh","year":"2012","journal-title":"Chem. Rev."},{"key":"D5CP04496K\/cit28\/1","doi-asserted-by":"crossref","first-page":"528","DOI":"10.1016\/j.cplett.2006.11.005","volume":"432","author":"Zhang","year":"2006","journal-title":"Chem. Phys. Lett."},{"key":"D5CP04496K\/cit29\/1","doi-asserted-by":"crossref","first-page":"8209","DOI":"10.1039\/D2CP05955J","volume":"25","author":"Karak","year":"2023","journal-title":"Phys. Chem. Chem. Phys."},{"key":"D5CP04496K\/cit30\/1","doi-asserted-by":"crossref","first-page":"1390","DOI":"10.1063\/1.1742314","volume":"23","author":"Michael Beer","year":"1955","journal-title":"J. Chem. Phys."},{"key":"D5CP04496K\/cit31\/1","doi-asserted-by":"crossref","first-page":"21569","DOI":"10.1021\/jacs.3c07625","volume":"145","author":"Dunlop","year":"2023","journal-title":"J. Am. Chem. Soc."},{"key":"D5CP04496K\/cit32\/1","doi-asserted-by":"crossref","first-page":"154305","DOI":"10.1063\/5.0113908","volume":"157","author":"Braun","year":"2022","journal-title":"J. Chem. Phys."},{"key":"D5CP04496K\/cit33\/1","doi-asserted-by":"crossref","first-page":"929","DOI":"10.1103\/PhysRev.86.929","volume":"86","author":"Kubo","year":"1952","journal-title":"Phys. Rev."},{"key":"D5CP04496K\/cit34\/1","doi-asserted-by":"crossref","first-page":"570","DOI":"10.1143\/JPSJ.12.570","volume":"12","author":"Kubo","year":"1957","journal-title":"J. Phys. Soc. Jpn."},{"key":"D5CP04496K\/cit35\/1","volume-title":"Principles of nonlinear optical spectroscopy","author":"Mukamel","year":"1995","unstructured":"S.Mukamel ,  Principles of nonlinear optical spectroscopy ,  Oxford university press ,  New York ,  1995 , vol. 6"},{"key":"D5CP04496K\/cit36\/1","doi-asserted-by":"crossref","first-page":"114302","DOI":"10.1063\/1.2710274","volume":"126","author":"Peng","year":"2007","journal-title":"J. Chem. Phys."},{"key":"D5CP04496K\/cit37\/1","doi-asserted-by":"crossref","first-page":"154105","DOI":"10.1063\/1.3575582","volume":"134","author":"Etinski","year":"2011","journal-title":"J. Chem. Phys."},{"key":"D5CP04496K\/cit38\/1","doi-asserted-by":"crossref","first-page":"13448","DOI":"10.1021\/acs.jpcc.7b00692","volume":"121","author":"Peng","year":"2017","journal-title":"J. Phys. Chem. C"},{"key":"D5CP04496K\/cit39\/1","doi-asserted-by":"crossref","first-page":"6975","DOI":"10.1021\/acs.chemrev.7b00617","volume":"118","author":"Penfold","year":"2018","journal-title":"Chem. Rev."},{"key":"D5CP04496K\/cit40\/1","doi-asserted-by":"crossref","first-page":"621","DOI":"10.1021\/acs.jctc.9b01014","volume":"16","author":"Kim","year":"2019","journal-title":"J. Chem. Theory Comput."},{"key":"D5CP04496K\/cit41\/1","doi-asserted-by":"crossref","first-page":"174101","DOI":"10.1063\/5.0120068","volume":"157","author":"Karak","year":"2022","journal-title":"J. Chem. Phys."},{"key":"D5CP04496K\/cit42\/1","doi-asserted-by":"crossref","first-page":"9439","DOI":"10.1039\/D3SC02453A","volume":"14","author":"MacDonell","year":"2023","journal-title":"Chem. Sci."},{"key":"D5CP04496K\/cit43\/1","doi-asserted-by":"crossref","first-page":"2379","DOI":"10.1039\/C9CP06089H","volume":"22","author":"Greiner","year":"2020","journal-title":"Phys. Chem. Chem. Phys."},{"key":"D5CP04496K\/cit44\/1","doi-asserted-by":"crossref","first-page":"034104","DOI":"10.1063\/1.5010895","volume":"148","author":"De Souza","year":"2018","journal-title":"J. Chem. Phys."},{"key":"D5CP04496K\/cit45\/1","first-page":"187","volume":"2","author":"Marian","year":"2012","journal-title":"Wiley Interdiscip. Rev.: Comput. Mol. Sci."},{"key":"D5CP04496K\/cit46\/1","doi-asserted-by":"crossref","first-page":"215","DOI":"10.1016\/j.chemphys.2010.03.004","volume":"370","author":"Peng","year":"2010","journal-title":"Chem. Phys."},{"key":"D5CP04496K\/cit47\/1","doi-asserted-by":"crossref","first-page":"4483","DOI":"10.1021\/ct300664d","volume":"8","author":"Stendardo","year":"2012","journal-title":"J. Chem. Theory Comput."},{"key":"D5CP04496K\/cit48\/1","doi-asserted-by":"crossref","first-page":"e1606","DOI":"10.1002\/wcms.1606","volume":"12","author":"Neese","year":"2022","journal-title":"WIREs Comput. Mol. Sci."},{"key":"D5CP04496K\/cit49\/1","doi-asserted-by":"crossref","first-page":"626","DOI":"10.1002\/jcc.27027","volume":"44","author":"Cerezo","year":"2023","journal-title":"J. Comput. Chem."},{"key":"D5CP04496K\/cit50\/1","doi-asserted-by":"crossref","first-page":"1078","DOI":"10.1080\/00268976.2017.1402966","volume":"116","author":"Niu","year":"2018","journal-title":"Mol. Phys."},{"key":"D5CP04496K\/cit51\/1","doi-asserted-by":"crossref","first-page":"931","DOI":"10.1002\/jcc.1056","volume":"22","author":"Te Velde","year":"2001","journal-title":"J. Comput. Chem."},{"key":"D5CP04496K\/cit52\/1","unstructured":"Keniya00, Keniya00\/Phos_spectra_simulation: Vibrationally_resolved_phos_spectra_simulation, 2025,  https:\/\/doi.org\/10.5281\/zenodo.17331090"},{"key":"D5CP04496K\/cit53\/1","doi-asserted-by":"crossref","first-page":"8209","DOI":"10.1039\/D2CP05955J","volume":"25","author":"Karak","year":"2023","journal-title":"Phys. Chem. Chem. Phys."},{"key":"D5CP04496K\/cit54\/1","first-page":"258","volume-title":"Relativistic Effects on Photodynamical Processes","author":"Karak","year":"2024","unstructured":"P.Karak ,  T.Moitra  and  S.Chakrabarti ,  Relativistic Effects on Photodynamical Processes , Elsevier,  Oxford , 1st edn,  2024 ,  pp. 258\u2013279"},{"key":"D5CP04496K\/cit55\/1","doi-asserted-by":"crossref","first-page":"24399","DOI":"10.1039\/D0CP04713A","volume":"22","author":"Karak","year":"2020","journal-title":"Phys. Chem. Chem. Phys."},{"key":"D5CP04496K\/cit56\/1","author":"swapanchem","year":"2025","unstructured":"swapanchem  and  P.Karak , swapanchem\/Rate-constant-ISC-RISC: ISC\/RISC_RATE_CONSTANT_V3.0,  2025 ,  https:\/\/doi.org\/10.5281\/zenodo.14961905"},{"key":"D5CP04496K\/cit57\/1","author":"swapanchem","year":"2025","unstructured":"swapanchem  and  P.Karak , swapanchem\/IC_RATE_CONSTANT_MPI: IC_RATE_CONSTANT_MPI_V3.0,  2025 ,  https:\/\/doi.org\/10.5281\/zenodo.15561422"},{"key":"D5CP04496K\/cit59\/1","first-page":"e1331","volume":"8","author":"Shiozaki","year":"2018","journal-title":"Wiley Interdiscip. Rev.: Comput. Mol. Sci."},{"key":"D5CP04496K\/cit60\/1","doi-asserted-by":"crossref","first-page":"1864","DOI":"10.1039\/C6NJ02747D","volume":"41","author":"Chen","year":"2017","journal-title":"New J. Chem."},{"key":"D5CP04496K\/cit61\/1","doi-asserted-by":"crossref","first-page":"16879","DOI":"10.1021\/acs.jpcc.4c04732","volume":"128","author":"Karak","year":"2024","journal-title":"J. Phys. Chem. C"},{"key":"D5CP04496K\/cit62\/1","doi-asserted-by":"crossref","first-page":"239","DOI":"10.1021\/acs.jpca.1c08456","volume":"126","author":"Lin","year":"2022","journal-title":"J. Phys. Chem. A"}],"container-title":["Physical Chemistry Chemical Physics"],"original-title":[],"language":"en","link":[{"URL":"http:\/\/pubs.rsc.org\/en\/content\/articlepdf\/2026\/CP\/D5CP04496K","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2026,7,1]],"date-time":"2026-07-01T22:07:19Z","timestamp":1782943639000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.rsc.org\/cp\/article\/28\/8\/5408-5417\/887800"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2026]]},"references-count":61,"journal-issue":{"issue":"8","published-print":{"date-parts":[[2026,2,25]]}},"URL":"https:\/\/doi.org\/10.1039\/d5cp04496k","relation":{"has-review":[{"id-type":"doi","id":"10.1039\/D5CP04496K\/v2\/decision1","asserted-by":"object"},{"id-type":"doi","id":"10.1039\/D5CP04496K\/v1\/review2","asserted-by":"object"},{"id-type":"doi","id":"10.1039\/D5CP04496K\/v1\/review1","asserted-by":"object"},{"id-type":"doi","id":"10.1039\/D5CP04496K\/v2\/review1","asserted-by":"object"},{"id-type":"doi","id":"10.1039\/D5CP04496K\/v2\/response1","asserted-by":"object"},{"id-type":"doi","id":"10.1039\/D5CP04496K\/v1\/decision1","asserted-by":"object"}]},"ISSN":["1463-9076","1463-9084"],"issn-type":[{"value":"1463-9076","type":"print"},{"value":"1463-9084","type":"electronic"}],"subject":[],"published":{"date-parts":[[2026]]}}}