184 related articles for article (PubMed ID: 36214920)
1. Computational investigations on acceptor substituent influence of metal-free efficient chromophores for optoelectronic properties.
Ammasi A; Munusamy AP; Shkir M
J Mol Model; 2022 Oct; 28(11):349. PubMed ID: 36214920
[TBL] [Abstract][Full Text] [Related]
2. Theoretical investigation of the effect of changing the auxiliary acceptor on the performance of organic D-A'-A dyes used as sensitizers in DSSCs.
Bouzineb Y; Fitri A; Benjelloun AT; Benzakour M; Mcharfi M; Bouachrine M
J Mol Model; 2023 Nov; 29(12):365. PubMed ID: 37946060
[TBL] [Abstract][Full Text] [Related]
3. Designed complexes combining brazilein and brazilin with betanidin for dye-sensitized solar cell application: DFT and TD-DFT study.
Malashi NM; Chande Jande YA; Wazzan N; Safi Z; Al-Qurashi OS; Costa R
J Mol Graph Model; 2024 Mar; 127():108691. PubMed ID: 38086144
[TBL] [Abstract][Full Text] [Related]
4. Investigating functional performance and substituent effect in modelling molecular structure, UV-visible spectra, and optical properties of D-π-A conjugated organic dye molecules: a DFT and TD-DFT study.
Chanana G; Batra K
J Mol Model; 2021 Jul; 27(8):229. PubMed ID: 34302223
[TBL] [Abstract][Full Text] [Related]
5. Theoretical investigation of new thiazolothiazole-based D-π-A organic dyes for efficient dye-sensitized solar cell.
Fitri A; Benjelloun AT; Benzakour M; Mcharfi M; Hamidi M; Bouachrine M
Spectrochim Acta A Mol Biomol Spectrosc; 2014 Apr; 124():646-54. PubMed ID: 24513712
[TBL] [Abstract][Full Text] [Related]
6. Computational method on highly efficient D-π-A-π-D-based different molecular acceptors for organic solar cells applications and non-linear optical behaviour.
Arunkumar A; Ju XH
Spectrochim Acta A Mol Biomol Spectrosc; 2024 Sep; 317():124391. PubMed ID: 38704998
[TBL] [Abstract][Full Text] [Related]
7. Exploration of Pull-Push Effect for Novel Photovoltaic Dyes with A-π-D Design: A DFT/TD-DFT Investigation.
Hassan AU; Sumrra SH
J Fluoresc; 2022 Nov; 32(6):1999-2014. PubMed ID: 35802211
[TBL] [Abstract][Full Text] [Related]
8. 1,2,4-Triazine-based Materials: Spectroscopic Investigation, DFT, NBO, and TD-DFT Calculations as Well As Dye-sensitized Solar Cells Applications.
Sakr MAS; Kana MTHA
J Fluoresc; 2022 Nov; 32(6):2053-2063. PubMed ID: 35861897
[TBL] [Abstract][Full Text] [Related]
9. Enhancing NLO performance by utilizing tyrian purple dye as donor moiety in organic DSSCs with end capped acceptors: A theoretical study.
Hassan AU; Sumrra SH; Mustafa G; Noreen S; Ali A; Sara S; Imran M
J Mol Graph Model; 2023 Nov; 124():108538. PubMed ID: 37327646
[TBL] [Abstract][Full Text] [Related]
10. Impact of doping with organic dopants and mixed doping with alkali metals and organic dopants on the absorption, electronic, optoelectronic, thermodynamic and nonlinear optical properties of dibenzo[b,def]chrysene in gaseous media: DFT and TD-DFT studies.
Bessong CDRA; Abe MTO; Ntieche Z; Noudem P; Fankam Fankam JB; Ndjaka JMB
J Mol Model; 2024 Jul; 30(8):240. PubMed ID: 38954155
[TBL] [Abstract][Full Text] [Related]
11. Electron Donor and Acceptor Influence on the Nonlinear Optical Response of Diacetylene-Functionalized Organic Materials (DFOMs): Density Functional Theory Calculations.
Khalid M; Hussain R; Hussain A; Ali B; Jaleel F; Imran M; Assiri MA; Khan MU; Ahmed S; Abid S; Haq S; Saleem K; Majeed S; Tariq CJ
Molecules; 2019 Jun; 24(11):. PubMed ID: 31159484
[TBL] [Abstract][Full Text] [Related]
12. Molecular design of benzo[c][1,2,5]thiadiazole or thieno[3,4-d]pyridazine-based auxiliary acceptors through different anchoring groups in D-π-A-A framework: A DFT/TD-DFT study.
Marlina LA; Haryadi W; Daengngern R; Pranowo HD
J Mol Graph Model; 2022 Jun; 113():108148. PubMed ID: 35180574
[TBL] [Abstract][Full Text] [Related]
13. Efficient and tunable enhancement of NLO performance for indaceno-based donor moiety in A-π-D-π-D-π-A type first DSSC design by end-capped acceptors.
Hassan AU; Sumrra SH; Mustafa G; Nazar MF; Zafar MN
J Mol Model; 2022 Dec; 29(1):4. PubMed ID: 36481993
[TBL] [Abstract][Full Text] [Related]
14. Molecular design of donor-acceptor dyes for efficient dye-sensitized solar cells I: a DFT study.
El-Shishtawy RM; Asiri AM; Aziz SG; Elroby SA
J Mol Model; 2014 Jun; 20(6):2241. PubMed ID: 24867437
[TBL] [Abstract][Full Text] [Related]
15. DFT and TD-DFT studies for optoelectronic properties of coumarin based donor-π-acceptor (D-π-A) dyes: applications in dye-sensitized solar cells (DSSCS).
Vuai SAH; Khalfan MS; Babu NS
Heliyon; 2021 Nov; 7(11):e08339. PubMed ID: 34816038
[TBL] [Abstract][Full Text] [Related]
16. The effect of different π-bridge configuration on bi-anchored triphenylamine and phenyl modified triphenylamine based dyes for dye sensitized solar cell (DSSC) application: A theoretical approach.
Pounraj P; Mohankumar V; Pandian MS; Ramasamy P
J Mol Graph Model; 2018 Jan; 79():235-253. PubMed ID: 29272760
[TBL] [Abstract][Full Text] [Related]
17. DFT and TD-DFT calculation of new thienopyrazine-based small molecules for organic solar cells.
Bourass M; Benjelloun AT; Benzakour M; Mcharfi M; Hamidi M; Bouzzine SM; Bouachrine M
Chem Cent J; 2016; 10():67. PubMed ID: 27843488
[TBL] [Abstract][Full Text] [Related]
18. TD-DFT investigation of D-π-A organic dyes with thiophene moieties as π-spacers for use as sensitizers in DSSCs.
Hasanein AA; Elmarassi YR; Kassem EN
J Mol Model; 2016 May; 22(5):115. PubMed ID: 27126050
[TBL] [Abstract][Full Text] [Related]
19. The effect of central transition metals and electron-donating substituent on the performances of dye/TiO
Abdel Aal S; Awadh D
J Mol Graph Model; 2023 Sep; 123():108525. PubMed ID: 37229869
[TBL] [Abstract][Full Text] [Related]
20. Optical Absorption Spectra and Electronic Properties of Symmetric and Asymmetric Squaraine Dyes for Use in DSSC Solar Cells: DFT and TD-DFT Studies.
El-Shishtawy RM; Elroby SA; Asiri AM; Müllen K
Int J Mol Sci; 2016 Apr; 17(4):487. PubMed ID: 27043556
[TBL] [Abstract][Full Text] [Related]
[Next] [New Search]
