FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W4281902008> ?p ?o ?g. }

• W4281902008 endingPage "139726" @default.
• W4281902008 startingPage "139726" @default.
• W4281902008 abstract "Four new donor molecules based on benzothiadiazole (BT) core namely BTA1, BTA2, BTA3 and BTA4 have been designed with A-D-A configuration. Quantum chemical simulations represent that these molecules show the best optoelectronic properties just like model compound BTIC-2Cl-γCF3. BTA3 and BTA4 showed the red shifted absorption value (685 nm and 633 nm) respectively as well as lowest band gap 2.31 eV and 2.27 eV respectively. The findings of DOS and FMO for modified acceptor moieties have been found nearly identical, indicating that electron density is distributed over the whole molecule for all designed molecules. BTA3 has minimum electron mobility 0.0086897 eV that makes it a good candidate for efficient solar cell. Binding energy (Eb) of BTA1, BTA2 and BTA4 is less than that of BTIC-2Cl-γCF3 indicating greater dissociation of excitons. BTA4 has the highest dipole moment among all molecules. As a result, this would be the best molecule for fabricating solar cell sheets. These four newly designed A-D-A donor molecules are therefore proposed as appropriate donor materials for highly efficient organic solar cell (OSC) devices." @default.
• W4281902008 created "2022-06-13" @default.
• W4281902008 creator A5003378095 @default.
• W4281902008 creator A5017592336 @default.
• W4281902008 creator A5022814180 @default.
• W4281902008 creator A5051602102 @default.
• W4281902008 creator A5054796654 @default.
• W4281902008 creator A5059279038 @default.
• W4281902008 creator A5077438724 @default.
• W4281902008 date "2022-08-01" @default.
• W4281902008 modified "2023-09-26" @default.
• W4281902008 title "Quantum chemical simulations of benzothiadiazole (BT) based small molecule donor materials for efficient organic solar cells" @default.
• W4281902008 cites W131059294 @default.
• W4281902008 cites W1842233119 @default.
• W4281902008 cites W1912044463 @default.
• W4281902008 cites W1989854295 @default.
• W4281902008 cites W1998602715 @default.
• W4281902008 cites W2008920194 @default.
• W4281902008 cites W2018962103 @default.
• W4281902008 cites W2022711672 @default.
• W4281902008 cites W2061106683 @default.
• W4281902008 cites W2062852634 @default.
• W4281902008 cites W2063333775 @default.
• W4281902008 cites W2071492131 @default.
• W4281902008 cites W2076584562 @default.
• W4281902008 cites W2082917109 @default.
• W4281902008 cites W2085123660 @default.
• W4281902008 cites W2112850441 @default.
• W4281902008 cites W2119418805 @default.
• W4281902008 cites W2174056229 @default.
• W4281902008 cites W2403824339 @default.
• W4281902008 cites W2549742474 @default.
• W4281902008 cites W2558695403 @default.
• W4281902008 cites W2564764456 @default.
• W4281902008 cites W2765935634 @default.
• W4281902008 cites W2789787743 @default.
• W4281902008 cites W2790226110 @default.
• W4281902008 cites W2792783390 @default.
• W4281902008 cites W2900957533 @default.
• W4281902008 cites W2903023610 @default.
• W4281902008 cites W2903449520 @default.
• W4281902008 cites W2904161998 @default.
• W4281902008 cites W2920079684 @default.
• W4281902008 cites W2933952620 @default.
• W4281902008 cites W2983668229 @default.
• W4281902008 cites W3009570344 @default.
• W4281902008 cites W3018972895 @default.
• W4281902008 cites W3039689117 @default.
• W4281902008 cites W3098980479 @default.
• W4281902008 cites W3115838086 @default.
• W4281902008 cites W3123729400 @default.
• W4281902008 cites W3173752063 @default.
• W4281902008 cites W3181867528 @default.
• W4281902008 cites W3191719718 @default.
• W4281902008 cites W3192571972 @default.
• W4281902008 cites W3192971571 @default.
• W4281902008 cites W3194397855 @default.
• W4281902008 cites W3201001746 @default.
• W4281902008 cites W4200093281 @default.
• W4281902008 cites W4206221537 @default.
• W4281902008 cites W4211160986 @default.
• W4281902008 cites W4223909723 @default.
• W4281902008 cites W4240034950 @default.
• W4281902008 doi "https://doi.org/10.1016/j.cplett.2022.139726" @default.
• W4281902008 hasPublicationYear "2022" @default.
• W4281902008 type Work @default.
• W4281902008 citedByCount "2" @default.
• W4281902008 countsByYear W42819020082022 @default.
• W4281902008 countsByYear W42819020082023 @default.
• W4281902008 crossrefType "journal-article" @default.
• W4281902008 hasAuthorship W4281902008A5003378095 @default.
• W4281902008 hasAuthorship W4281902008A5017592336 @default.
• W4281902008 hasAuthorship W4281902008A5022814180 @default.
• W4281902008 hasAuthorship W4281902008A5051602102 @default.
• W4281902008 hasAuthorship W4281902008A5054796654 @default.
• W4281902008 hasAuthorship W4281902008A5059279038 @default.
• W4281902008 hasAuthorship W4281902008A5077438724 @default.
• W4281902008 hasConcept C102931765 @default.
• W4281902008 hasConcept C121332964 @default.
• W4281902008 hasConcept C147789679 @default.
• W4281902008 hasConcept C159467904 @default.
• W4281902008 hasConcept C173523689 @default.
• W4281902008 hasConcept C178790620 @default.
• W4281902008 hasConcept C181966813 @default.
• W4281902008 hasConcept C185592680 @default.
• W4281902008 hasConcept C192562407 @default.
• W4281902008 hasConcept C26873012 @default.
• W4281902008 hasConcept C2779892579 @default.
• W4281902008 hasConcept C2780824857 @default.
• W4281902008 hasConcept C2900893 @default.
• W4281902008 hasConcept C2991951333 @default.
• W4281902008 hasConcept C32909587 @default.
• W4281902008 hasConcept C49040817 @default.
• W4281902008 hasConcept C521977710 @default.
• W4281902008 hasConcept C75473681 @default.
• W4281902008 hasConcept C91614233 @default.
• W4281902008 hasConceptScore W4281902008C102931765 @default.
• W4281902008 hasConceptScore W4281902008C121332964 @default.

• next