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Items: 1 to 50 of 282

1.

Intramolecular Noncovalent Interactions Facilitate Thermally Activated Delayed Fluorescence (TADF).

Chen XK, Bakr BW, Auffray M, Tsuchiya Y, Sherrill CD, Adachi C, Bredas JL.

J Phys Chem Lett. 2019 Jun 20;10(12):3260-3268. doi: 10.1021/acs.jpclett.9b01220. Epub 2019 Jun 4.

PMID:
31141375
2.

Emergence of an Antiferromagnetic Mott Insulating Phase in Hexagonal π-Conjugated Covalent Organic Frameworks.

Thomas S, Li H, Bredas JL.

Adv Mater. 2019 Apr;31(17):e1900355. doi: 10.1002/adma.201900355. Epub 2019 Mar 7.

PMID:
30847999
3.

Assessing the nature of the charge-transfer electronic states in organic solar cells.

Chen XK, Coropceanu V, Brédas JL.

Nat Commun. 2018 Dec 13;9(1):5295. doi: 10.1038/s41467-018-07707-8.

4.

Local Electronic Structure of Molecular Heterojunctions in a Single-Layer 2D Covalent Organic Framework.

Joshi T, Chen C, Li H, Diercks CS, Wang G, Waller PJ, Li H, Bredas JL, Yaghi OM, Crommie MF.

Adv Mater. 2019 Jan;31(3):e1805941. doi: 10.1002/adma.201805941. Epub 2018 Nov 28.

PMID:
30484915
5.

Quasi-One-Dimensional Charge Transport Can Lead to Nonlinear Current Characteristics in Organic Field-Effect Transistors.

Li H, Brédas JL.

J Phys Chem Lett. 2018 Nov 15;9(22):6550-6555. doi: 10.1021/acs.jpclett.8b02972. Epub 2018 Nov 5.

PMID:
30380867
6.

Efficient Electron Mobility in an All-Acceptor Napthalenediimide-Bithiazole Polymer Semiconductor with Large Backbone Torsion.

Ly JT, Burnett EK, Thomas S, Aljarb A, Liu Y, Park S, Rosa S, Yi Y, Lee H, Emrick T, Russell TP, Brédas JL, Briseno AL.

ACS Appl Mater Interfaces. 2018 Nov 21;10(46):40070-40077. doi: 10.1021/acsami.8b11234. Epub 2018 Nov 12.

PMID:
30379059
7.

Synthesis and properties of isoindigo and benzo[1,2-b:4,5-b']bis[b]benzothiophene oligomers.

Liao H, Xiao C, Ravva MK, Wang Y, Little M, Jenart MVC, Onwubiko A, Li Z, Wang Z, Brédas JL, McCulloch I, Yue W.

Chem Commun (Camb). 2018 Oct 2;54(79):11152-11155. doi: 10.1039/c8cc05608k.

PMID:
30226223
8.

Halogen Migration in Hybrid Perovskites: The Organic Cation Matters.

Oranskaia A, Yin J, Bakr OM, Brédas JL, Mohammed OF.

J Phys Chem Lett. 2018 Sep 20;9(18):5474-5480. doi: 10.1021/acs.jpclett.8b02522. Epub 2018 Sep 10.

PMID:
30187754
9.

Point Defects and Green Emission in Zero-Dimensional Perovskites.

Yin J, Yang H, Song K, El-Zohry AM, Han Y, Bakr OM, Brédas JL, Mohammed OF.

J Phys Chem Lett. 2018 Sep 20;9(18):5490-5495. doi: 10.1021/acs.jpclett.8b02477. Epub 2018 Sep 10.

PMID:
30180582
10.

Thermally Activated Delayed Fluorescence (TADF) Path toward Efficient Electroluminescence in Purely Organic Materials: Molecular Level Insight.

Chen XK, Kim D, Brédas JL.

Acc Chem Res. 2018 Sep 18;51(9):2215-2224. doi: 10.1021/acs.accounts.8b00174. Epub 2018 Aug 24.

PMID:
30141908
11.

Design rules for minimizing voltage losses in high-efficiency organic solar cells.

Qian D, Zheng Z, Yao H, Tress W, Hopper TR, Chen S, Li S, Liu J, Chen S, Zhang J, Liu XK, Gao B, Ouyang L, Jin Y, Pozina G, Buyanova IA, Chen WM, Inganäs O, Coropceanu V, Bredas JL, Yan H, Hou J, Zhang F, Bakulin AA, Gao F.

Nat Mater. 2018 Aug;17(8):703-709. doi: 10.1038/s41563-018-0128-z. Epub 2018 Jul 16.

12.

Large Out-of-Plane Deformations of Two-Dimensional Covalent Organic Framework (COF) Sheets.

Li H, Brédas JL.

J Phys Chem Lett. 2018 Aug 2;9(15):4215-4220. doi: 10.1021/acs.jpclett.8b01762. Epub 2018 Jul 13.

PMID:
29983057
13.

Increased Exciton Delocalization of Polymer upon Blending with Fullerene.

Gautam B, Klump E, Yi X, Constantinou I, Shewmon N, Salehi A, Lo CK, Zheng Z, Brédas JL, Gundogdu K, Reynolds JR, So F.

Adv Mater. 2018 Jul;30(30):e1801392. doi: 10.1002/adma.201801392. Epub 2018 Jun 11.

PMID:
29893011
14.

Langmuir-Blodgett Thin Films of Diketopyrrolopyrrole-Based Amphiphiles.

Lo CK, Wang CY, Oosterhout SD, Zheng Z, Yi X, Fuentes-Hernandez C, So F, Coropceanu V, Brédas JL, Toney MF, Kippelen B, Reynolds JR.

ACS Appl Mater Interfaces. 2018 Apr 11;10(14):11995-12004. doi: 10.1021/acsami.7b18239. Epub 2018 Mar 30.

PMID:
29601173
15.

Bond Ellipticity Alternation: An Accurate Descriptor of the Nonlinear Optical Properties of π-Conjugated Chromophores.

Lopes TO, Machado DFS, Risko C, Brédas JL, de Oliveira HCB.

J Phys Chem Lett. 2018 Mar 15;9(6):1377-1383. doi: 10.1021/acs.jpclett.8b00478. Epub 2018 Mar 6.

PMID:
29498530
16.

Quantitative relations between interaction parameter, miscibility and function in organic solar cells.

Ye L, Hu H, Ghasemi M, Wang T, Collins BA, Kim JH, Jiang K, Carpenter JH, Li H, Li Z, McAfee T, Zhao J, Chen X, Lai JLY, Ma T, Bredas JL, Yan H, Ade H.

Nat Mater. 2018 Mar;17(3):253-260. doi: 10.1038/s41563-017-0005-1. Epub 2018 Feb 5.

PMID:
29403053
17.

Fused electron deficient semiconducting polymers for air stable electron transport.

Onwubiko A, Yue W, Jellett C, Xiao M, Chen HY, Ravva MK, Hanifi DA, Knall AC, Purushothaman B, Nikolka M, Flores JC, Salleo A, Bredas JL, Sirringhaus H, Hayoz P, McCulloch I.

Nat Commun. 2018 Jan 29;9(1):416. doi: 10.1038/s41467-018-02852-6.

18.

Local Electronic Structure of a Single-Layer Porphyrin-Containing Covalent Organic Framework.

Chen C, Joshi T, Li H, Chavez AD, Pedramrazi Z, Liu PN, Li H, Dichtel WR, Bredas JL, Crommie MF.

ACS Nano. 2018 Jan 23;12(1):385-391. doi: 10.1021/acsnano.7b06529. Epub 2017 Dec 26.

PMID:
29261279
19.

Molecular behavior of zero-dimensional perovskites.

Yin J, Maity P, De Bastiani M, Dursun I, Bakr OM, Brédas JL, Mohammed OF.

Sci Adv. 2017 Dec 15;3(12):e1701793. doi: 10.1126/sciadv.1701793. eCollection 2017 Dec.

20.

Understanding the effects of electronic polarization and delocalization on charge-transport levels in oligoacene systems.

Sutton C, Tummala NR, Kemper T, Aziz SG, Sears J, Coropceanu V, Brédas JL.

J Chem Phys. 2017 Jun 14;146(22):224705. doi: 10.1063/1.4984783.

PMID:
29166056
21.

Isoindigo-3,4-Difluorothiophene Polymer Acceptors Yield "All-Polymer" Bulk-Heterojunction Solar Cells with over 7 % Efficiency.

Liu S, Firdaus Y, Thomas S, Kan Z, Cruciani F, Lopatin S, Bredas JL, Beaujuge PM.

Angew Chem Int Ed Engl. 2018 Jan 8;57(2):531-535. doi: 10.1002/anie.201709509. Epub 2017 Dec 6.

PMID:
29154413
22.

Nucleation and Growth of Covalent Organic Frameworks from Solution: The Example of COF-5.

Li H, Chavez AD, Li H, Li H, Dichtel WR, Bredas JL.

J Am Chem Soc. 2017 Nov 15;139(45):16310-16318. doi: 10.1021/jacs.7b09169. Epub 2017 Oct 31.

PMID:
29058430
23.

A New Design Strategy for Efficient Thermally Activated Delayed Fluorescence Organic Emitters: From Twisted to Planar Structures.

Chen XK, Tsuchiya Y, Ishikawa Y, Zhong C, Adachi C, Brédas JL.

Adv Mater. 2017 Dec;29(46). doi: 10.1002/adma.201702767. Epub 2017 Oct 17.

PMID:
29044726
24.

Energetic fluctuations in amorphous semiconducting polymers: Impact on charge-carrier mobility.

Gali SM, D'Avino G, Aurel P, Han G, Yi Y, Papadopoulos TA, Coropceanu V, Brédas JL, Hadziioannou G, Zannoni C, Muccioli L.

J Chem Phys. 2017 Oct 7;147(13):134904. doi: 10.1063/1.4996969.

PMID:
28987120
25.

Charge-Transfer Dynamics in the Lowest Excited State of a Pentacene-Fullerene Complex: Implications for Organic Solar Cells.

Joseph S, Ravva MK, Bredas JL.

J Phys Chem Lett. 2017 Oct 19;8(20):5171-5176. doi: 10.1021/acs.jpclett.7b02049. Epub 2017 Oct 9.

PMID:
28968105
26.

Impact of interfacial molecular orientation on radiative recombination and charge generation efficiency.

Ran NA, Roland S, Love JA, Savikhin V, Takacs CJ, Fu YT, Li H, Coropceanu V, Liu X, Brédas JL, Bazan GC, Toney MF, Neher D, Nguyen TQ.

Nat Commun. 2017 Jul 19;8(1):79. doi: 10.1038/s41467-017-00107-4.

27.

Effect of Solid-State Polarization on Charge-Transfer Excitations and Transport Levels at Organic Interfaces from a Screened Range-Separated Hybrid Functional.

Zheng Z, Egger DA, Brédas JL, Kronik L, Coropceanu V.

J Phys Chem Lett. 2017 Jul 20;8(14):3277-3283. doi: 10.1021/acs.jpclett.7b01276. Epub 2017 Jul 6.

PMID:
28666085
28.

Direct-Indirect Nature of the Bandgap in Lead-Free Perovskite Nanocrystals.

Zhang Y, Yin J, Parida MR, Ahmed GH, Pan J, Bakr OM, Brédas JL, Mohammed OF.

J Phys Chem Lett. 2017 Jul 20;8(14):3173-3177. doi: 10.1021/acs.jpclett.7b01381. Epub 2017 Jun 27.

PMID:
28644033
29.

Topological Transformation of π-Conjugated Molecules Reduces Resistance to Crystallization.

Zhou C, Cui Q, McDowell C, Seifrid M, Chen X, Brédas JL, Wang M, Huang F, Bazan GC.

Angew Chem Int Ed Engl. 2017 Aug 1;56(32):9318-9321. doi: 10.1002/anie.201702646. Epub 2017 Jul 4.

PMID:
28589619
30.

Kinetic Monte Carlo Modeling of Charge Carriers in Organic Electronic Devices: Suppression of the Self-Interaction Error.

Li H, Brédas JL.

J Phys Chem Lett. 2017 Jun 1;8(11):2507-2512. doi: 10.1021/acs.jpclett.7b01161. Epub 2017 May 22.

PMID:
28520427
31.

Charge-Transfer States in Organic Solar Cells: Understanding the Impact of Polarization, Delocalization, and Disorder.

Zheng Z, Tummala NR, Fu YT, Coropceanu V, Brédas JL.

ACS Appl Mater Interfaces. 2017 May 31;9(21):18095-18102. doi: 10.1021/acsami.7b02193. Epub 2017 May 17.

PMID:
28481497
32.

Impact of Dielectric Constant on the Singlet-Triplet Gap in Thermally Activated Delayed Fluorescence Materials.

Sun H, Hu Z, Zhong C, Chen X, Sun Z, Brédas JL.

J Phys Chem Lett. 2017 Jun 1;8(11):2393-2398. doi: 10.1021/acs.jpclett.7b00688. Epub 2017 May 12.

PMID:
28453937
33.

Up-Conversion Intersystem Crossing Rates in Organic Emitters for Thermally Activated Delayed Fluorescence: Impact of the Nature of Singlet vs Triplet Excited States.

Samanta PK, Kim D, Coropceanu V, Brédas JL.

J Am Chem Soc. 2017 Mar 22;139(11):4042-4051. doi: 10.1021/jacs.6b12124. Epub 2017 Mar 13.

PMID:
28244314
34.

Impact of morphology on polaron delocalization in a semicrystalline conjugated polymer.

Steyrleuthner R, Zhang Y, Zhang L, Kraffert F, Cherniawski BP, Bittl R, Briseno AL, Bredas JL, Behrends J.

Phys Chem Chem Phys. 2017 Feb 1;19(5):3627-3639. doi: 10.1039/c6cp07485e.

PMID:
28094360
35.

Photovoltaic concepts inspired by coherence effects in photosynthetic systems.

Brédas JL, Sargent EH, Scholes GD.

Nat Mater. 2016 Dec 20;16(1):35-44. doi: 10.1038/nmat4767. Review.

PMID:
27994245
36.

High operational and environmental stability of high-mobility conjugated polymer field-effect transistors through the use of molecular additives.

Nikolka M, Nasrallah I, Rose B, Ravva MK, Broch K, Sadhanala A, Harkin D, Charmet J, Hurhangee M, Brown A, Illig S, Too P, Jongman J, McCulloch I, Bredas JL, Sirringhaus H.

Nat Mater. 2017 Mar;16(3):356-362. doi: 10.1038/nmat4785. Epub 2016 Dec 12.

37.

Limits for Recombination in a Low Energy Loss Organic Heterojunction.

Menke SM, Sadhanala A, Nikolka M, Ran NA, Ravva MK, Abdel-Azeim S, Stern HL, Wang M, Sirringhaus H, Nguyen TQ, Brédas JL, Bazan GC, Friend RH.

ACS Nano. 2016 Dec 27;10(12):10736-10744. doi: 10.1021/acsnano.6b06211. Epub 2016 Nov 3.

38.

Benchmarking Post-Hartree-Fock Methods To Describe the Nonlinear Optical Properties of Polymethines: An Investigation of the Accuracy of Algebraic Diagrammatic Construction (ADC) Approaches.

Knippenberg S, Gieseking RL, Rehn DR, Mukhopadhyay S, Dreuw A, Brédas JL.

J Chem Theory Comput. 2016 Nov 8;12(11):5465-5476. Epub 2016 Oct 17.

PMID:
27715035
39.

Thieno[3,4-c]pyrrole-4,6-dione-3,4-difluorothiophene Polymer Acceptors for Efficient All-Polymer Bulk Heterojunction Solar Cells.

Liu S, Kan Z, Thomas S, Cruciani F, Brédas JL, Beaujuge PM.

Angew Chem Int Ed Engl. 2016 Oct 10;55(42):12996-13000. doi: 10.1002/anie.201604307.

PMID:
27633799
40.

Impact of Fluorine Substituents on π-Conjugated Polymer Main-Chain Conformations, Packing, and Electronic Couplings.

Do K, Saleem Q, Ravva MK, Cruciani F, Kan Z, Wolf J, Hansen MR, Beaujuge PM, Brédas JL.

Adv Mater. 2016 Oct;28(37):8197-8205. doi: 10.1002/adma.201601282. Epub 2016 Jul 14.

PMID:
27411743
41.

Description of the Charge Transfer States at the Pentacene/C60 Interface: Combining Range-Separated Hybrid Functionals with the Polarizable Continuum Model.

Zheng Z, Brédas JL, Coropceanu V.

J Phys Chem Lett. 2016 Jul 7;7(13):2616-21. doi: 10.1021/acs.jpclett.6b00911. Epub 2016 Jun 28.

PMID:
27338105
42.

Polarization Energies at Organic-Organic Interfaces: Impact on the Charge Separation Barrier at Donor-Acceptor Interfaces in Organic Solar Cells.

Ryno SM, Fu YT, Risko C, Brédas JL.

ACS Appl Mater Interfaces. 2016 Jun 22;8(24):15524-34. doi: 10.1021/acsami.6b02851. Epub 2016 Jun 8.

PMID:
27244215
43.

Phosphonic Acids for Interfacial Engineering of Transparent Conductive Oxides.

Paniagua SA, Giordano AJ, Smith OL, Barlow S, Li H, Armstrong NR, Pemberton JE, Brédas JL, Ginger D, Marder SR.

Chem Rev. 2016 Jun 22;116(12):7117-58. doi: 10.1021/acs.chemrev.6b00061. Epub 2016 May 26.

PMID:
27227316
44.

Impact of Molecular Orientation and Packing Density on Electronic Polarization in the Bulk and at Surfaces of Organic Semiconductors.

Ryno SM, Risko C, Brédas JL.

ACS Appl Mater Interfaces. 2016 Jun 8;8(22):14053-62. doi: 10.1021/acsami.6b02579. Epub 2016 May 25.

PMID:
27183361
45.

Ionization Energies, Electron Affinities, and Polarization Energies of Organic Molecular Crystals: Quantitative Estimations from a Polarizable Continuum Model (PCM)-Tuned Range-Separated Density Functional Approach.

Sun H, Ryno S, Zhong C, Ravva MK, Sun Z, Körzdörfer T, Brédas JL.

J Chem Theory Comput. 2016 Jun 14;12(6):2906-16. doi: 10.1021/acs.jctc.6b00225. Epub 2016 May 26.

PMID:
27183355
46.

Spiro-OMeTAD single crystals: Remarkably enhanced charge-carrier transport via mesoscale ordering.

Shi D, Qin X, Li Y, He Y, Zhong C, Pan J, Dong H, Xu W, Li T, Hu W, Brédas JL, Bakr OM.

Sci Adv. 2016 Apr 15;2(4):e1501491. doi: 10.1126/sciadv.1501491. eCollection 2016 Apr.

47.

Spectroscopy and control of near-surface defects in conductive thin film ZnO.

Kelly LL, Racke DA, Schulz P, Li H, Winget P, Kim H, Ndione P, Sigdel AK, Brédas JL, Berry JJ, Graham S, Monti OL.

J Phys Condens Matter. 2016 Mar 9;28(9):094007. doi: 10.1088/0953-8984/28/9/094007. Epub 2016 Feb 12.

PMID:
26871256
48.

Strain effects on the work function of an organic semiconductor.

Wu Y, Chew AR, Rojas GA, Sini G, Haugstad G, Belianinov A, Kalinin SV, Li H, Risko C, Brédas JL, Salleo A, Frisbie CD.

Nat Commun. 2016 Feb 1;7:10270. doi: 10.1038/ncomms10270.

49.

Accurate Ionization Potentials and Electron Affinities of Acceptor Molecules I. Reference Data at the CCSD(T) Complete Basis Set Limit.

Richard RM, Marshall MS, Dolgounitcheva O, Ortiz JV, Brédas JL, Marom N, Sherrill CD.

J Chem Theory Comput. 2016 Feb 9;12(2):595-604. doi: 10.1021/acs.jctc.5b00875. Epub 2016 Jan 25.

PMID:
26731487
50.

Static and Dynamic Energetic Disorders in the C60, PC61BM, C70, and PC71BM Fullerenes.

Tummala NR, Zheng Z, Aziz SG, Coropceanu V, Brédas JL.

J Phys Chem Lett. 2015 Sep 17;6(18):3657-62. doi: 10.1021/acs.jpclett.5b01709. Epub 2015 Sep 4.

PMID:
26722738

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