Simulation of time-resolved x-ray absorption spectroscopy of ultrafast dynamics in particle-hole-excited 4-(2-thienyl)-2,1,3-benzothiadiazole.
Journal
Structural dynamics (Melville, N.Y.)
ISSN: 2329-7778
Titre abrégé: Struct Dyn
Pays: United States
ID NLM: 101660872
Informations de publication
Date de publication:
Jul 2020
Jul 2020
Historique:
received:
27
03
2020
accepted:
15
06
2020
entrez:
16
7
2020
pubmed:
16
7
2020
medline:
16
7
2020
Statut:
epublish
Résumé
To date, alternating co-polymers based on electron-rich and electron-poor units are the most attractive materials to control functionality of organic semiconductor layers in which ultrafast excited-state processes play a key role. We present a computational study of the photoinduced excited-state dynamics of the 4-(2-thienyl)-2,1,3-benzothiadiazole (BT-1T) molecule, which is a common building block in the backbone of
Identifiants
pubmed: 32665964
doi: 10.1063/4.0000016
pii: 4.0000016
pmc: PMC7340508
doi:
Types de publication
Journal Article
Langues
eng
Pagination
044101Informations de copyright
© 2020 Author(s).
Références
Molecules. 2018 Nov 01;23(11):
pubmed: 30388739
Phys Chem Chem Phys. 2017 May 31;19(21):13604-13613
pubmed: 28518198
Phys Chem Chem Phys. 2013 Jun 21;15(23):9245-56
pubmed: 23657784
Science. 2017 Jan 20;355(6322):264-267
pubmed: 28059713
J Am Chem Soc. 2010 Dec 15;132(49):17459-70
pubmed: 21087001
Science. 2018 Sep 14;361(6407):1094-1098
pubmed: 30093603
J Chem Theory Comput. 2018 Sep 11;14(9):4530-4540
pubmed: 30091911
Nat Commun. 2015 Mar 02;6:6359
pubmed: 25727920
J Am Chem Soc. 2016 Jul 20;138(28):8752-64
pubmed: 27286410
J Phys Chem A. 2017 Oct 19;121(41):7937-7946
pubmed: 28953391
J Phys Chem B. 2012 Mar 1;116(8):2347-55
pubmed: 22303865
Chem Rev. 2004 Apr;104(4):1781-812
pubmed: 15080712
J Comput Chem. 2016 Feb 15;37(5):506-41
pubmed: 26561362
J Mol Graph. 1996 Feb;14(1):33-8, 27-8
pubmed: 8744570
Nat Mater. 2018 Jan 23;17(2):119-128
pubmed: 29358765
Chem Rev. 2009 Mar 11;109(3):897-1091
pubmed: 19228015
J Phys Chem Lett. 2015 Jan 2;6(1):13-21
pubmed: 26263085
Nat Commun. 2014 Nov 10;5:5293
pubmed: 25382026
J Chem Theory Comput. 2016 Jun 14;12(6):2652-60
pubmed: 27144975
Acc Chem Res. 2014 Apr 15;47(4):1155-64
pubmed: 24673100
Faraday Discuss. 2015;177:111-9
pubmed: 25607832
Struct Dyn. 2019 Jul 23;6(4):044102
pubmed: 31372369
Annu Rev Phys Chem. 2010;61:263-82
pubmed: 20055677
J Chem Theory Comput. 2019 Jun 11;15(6):3470-3480
pubmed: 31050425
Phys Chem Chem Phys. 2015 Jun 14;17(22):14719-30
pubmed: 25975584
Struct Dyn. 2017 Aug 14;4(5):054902
pubmed: 28852689
Polymers (Basel). 2018 Mar 12;10(3):
pubmed: 30966342
Phys Chem Chem Phys. 2015 Mar 28;17(12):7787-99
pubmed: 25714233
Struct Dyn. 2015 May 07;2(4):041707
pubmed: 26798806
Chem Soc Rev. 2018 Jun 18;47(12):4279-4294
pubmed: 29736541
Front Chem. 2019 Feb 12;7:61
pubmed: 30809519
Nat Mater. 2007 Jul;6(7):497-500
pubmed: 17529968