-
1
-
-
72849108485
-
Molecular Understanding of Organic Solar Cells: The Challenges
-
Brédas, J. L.; Norton, J. E.; Cornil, J.; Coropceanu, V. Molecular Understanding of Organic Solar Cells: The Challenges Acc. Chem. Res. 2009, 42, 1691-1699
-
(2009)
Acc. Chem. Res.
, vol.42
, pp. 1691-1699
-
-
Brédas, J.L.1
Norton, J.E.2
Cornil, J.3
Coropceanu, V.4
-
2
-
-
78449307271
-
Charge Photogeneration in Organic Solar Cells
-
Clarke, T. M.; Durrant, J. R. Charge Photogeneration in Organic Solar Cells Chem. Rev. 2010, 110, 6736-6767
-
(2010)
Chem. Rev.
, vol.110
, pp. 6736-6767
-
-
Clarke, T.M.1
Durrant, J.R.2
-
3
-
-
83755168929
-
Molecular Design and Ordering Effects in π-Functional Materials for Transistor and Solar Cell Applications
-
Beaujuge, P. M.; Fréchet, J. M. J. Molecular Design and Ordering Effects in π-Functional Materials for Transistor and Solar Cell Applications J. Am. Chem. Soc. 2011, 133, 20009-20029
-
(2011)
J. Am. Chem. Soc.
, vol.133
, pp. 20009-20029
-
-
Beaujuge, P.M.1
Fréchet, J.M.J.2
-
4
-
-
84874093850
-
Exploring the Energy Landscape of the Charge Transport Levels in Organic Semiconductors at the Molecular Scale
-
Cornil, J.; Verlaak, S.; Martinelli, N.; Mityashin, A.; Olivier, Y.; Van Regemorter, T.; D'Avino, G.; Muccioli, L.; Zannoni, C.; Castet, F. Exploring the Energy Landscape of the Charge Transport Levels in Organic Semiconductors at the Molecular Scale Acc. Chem. Res. 2013, 46, 434-443
-
(2013)
Acc. Chem. Res.
, vol.46
, pp. 434-443
-
-
Cornil, J.1
Verlaak, S.2
Martinelli, N.3
Mityashin, A.4
Olivier, Y.5
Van Regemorter, T.6
D'Avino, G.7
Muccioli, L.8
Zannoni, C.9
Castet, F.10
-
5
-
-
67649207662
-
Bulk Heterojunction Solar Cells with Internal Quantum Efficiency Approaching 100%
-
Park, S. H.; Roy, A.; Beaupré, S.; Cho, S.; Coates, N.; Moon, J. S.; Moses, D.; Leclerc, M.; Lee, K.; Heeger, A. J. Bulk Heterojunction Solar Cells With Internal Quantum Efficiency Approaching 100% Nat. Photonics 2009, 3, 297-302
-
(2009)
Nat. Photonics
, vol.3
, pp. 297-302
-
-
Park, S.H.1
Roy, A.2
Beaupré, S.3
Cho, S.4
Coates, N.5
Moon, J.S.6
Moses, D.7
Leclerc, M.8
Lee, K.9
Heeger, A.J.10
-
6
-
-
77951907456
-
For the Bright Future - Bulk Heterojunction Polymer Solar Cells with Power Conversion Efficiency of 7.4%
-
Liang, Y.; Xu, Z.; Xia, J.; Tsai, S.-T.; Wu, Y.; Li, G.; Ray, C.; Yu, L. For the Bright Future-Bulk Heterojunction Polymer Solar Cells with Power Conversion Efficiency of 7.4% Adv. Mater. 2010, 22, E135-E138
-
(2010)
Adv. Mater.
, vol.22
-
-
Liang, Y.1
Xu, Z.2
Xia, J.3
Tsai, S.-T.4
Wu, Y.5
Li, G.6
Ray, C.7
Yu, L.8
-
7
-
-
80051694469
-
P3HT:PCBM, Best Seller in Polymer Photovoltaic Research
-
Dang, M. T.; Hirsch, L.; Wantz, G. P3HT:PCBM, Best Seller in Polymer Photovoltaic Research Adv. Mater. 2011, 23, 3597-3602
-
(2011)
Adv. Mater.
, vol.23
, pp. 3597-3602
-
-
Dang, M.T.1
Hirsch, L.2
Wantz, G.3
-
8
-
-
51849102373
-
Charge-Transfer States in Conjugated Polymer/Fullerene Blends: Below-Gap Weakly Bound Excitons for Polymer Photovoltaics
-
Hallermann, M.; Haneder, S.; Da Como, E. Charge-Transfer States In Conjugated Polymer/Fullerene Blends: Below-Gap Weakly Bound Excitons For Polymer Photovoltaics Appl. Phys. Lett. 2008, 93, 053307
-
(2008)
Appl. Phys. Lett.
, vol.93
, pp. 053307
-
-
Hallermann, M.1
Haneder, S.2
Da Como, E.3
-
9
-
-
79953752807
-
The Binding Energy of Charge-Transfer Excitons Localized at Polymeric Semiconductor Heterojunctions
-
Gélinas, S.; Paré-Labrosse, O.; Brosseau, C. N.; Seifried, S. A.; McNeill, C. R.; Kirov, K. R.; Howard, I. A.; Leonelli, R.; Friend, R. H.; Silva, C. The Binding Energy of Charge-Transfer Excitons Localized at Polymeric Semiconductor Heterojunctions J. Phys. Chem. C 2011, 115, 7114-7119
-
(2011)
J. Phys. Chem. C
, vol.115
, pp. 7114-7119
-
-
Gélinas, S.1
Paré-Labrosse, O.2
Brosseau, C.N.3
Seifried, S.A.4
McNeill, C.R.5
Kirov, K.R.6
Howard, I.A.7
Leonelli, R.8
Friend, R.H.9
Silva, C.10
-
10
-
-
80155212924
-
Binding Energy of Singlet Excitons and Charge Transfer Complexes in MDMO-PPV:PCBM Solar Cells
-
Kern, J.; Schwab, S.; Deibel, C.; Dyakonov, V. Binding Energy Of Singlet Excitons And Charge Transfer Complexes In MDMO-PPV:PCBM Solar Cells Phys. Stat. Sol. RRL 2011, 5, 364-366
-
(2011)
Phys. Stat. Sol. RRL
, vol.5
, pp. 364-366
-
-
Kern, J.1
Schwab, S.2
Deibel, C.3
Dyakonov, V.4
-
11
-
-
77956064858
-
Charge Transfer State Versus Hot Exciton Dissociation in Polymer-Fullerene Blended Solar Cells
-
Lee, J.; Vandewal, K.; Yost, S. R.; Bahlke, M. E.; Goris, L.; Baldo, M. A.; Manca, J. V.; Van Voorhis, T. Charge Transfer State Versus Hot Exciton Dissociation in Polymer-Fullerene Blended Solar Cells J. Am. Chem. Soc. 2010, 132, 11878-11880
-
(2010)
J. Am. Chem. Soc.
, vol.132
, pp. 11878-11880
-
-
Lee, J.1
Vandewal, K.2
Yost, S.R.3
Bahlke, M.E.4
Goris, L.5
Baldo, M.A.6
Manca, J.V.7
Van Voorhis, T.8
-
12
-
-
77957578736
-
Optical Studies of the Charge Transfer Complex in Polythiophene/Fullerene Blends for Organic Photovoltaic Applications
-
Drori, T.; Holt, J.; Vardeny, Z. V. Optical Studies Of The Charge Transfer Complex In Polythiophene/Fullerene Blends For Organic Photovoltaic Applications Phys. Rev. B 2010, 82, 075207
-
(2010)
Phys. Rev. B
, vol.82
, pp. 075207
-
-
Drori, T.1
Holt, J.2
Vardeny, Z.V.3
-
13
-
-
69049093843
-
Electroluminescence from Charge Transfer States in Polymer Solar Cells
-
Tvingstedt, K.; Vandewal, K.; Gadisa, A.; Zhang, F.; Manca, J.; Inganas, O. Electroluminescence from Charge Transfer States in Polymer Solar Cells J. Am. Chem. Soc. 2009, 131, 11819-11824
-
(2009)
J. Am. Chem. Soc.
, vol.131
, pp. 11819-11824
-
-
Tvingstedt, K.1
Vandewal, K.2
Gadisa, A.3
Zhang, F.4
Manca, J.5
Inganas, O.6
-
14
-
-
0037706312
-
Why Is Exciton Dissociation so Efficient at the Interface between A Conjugated Polymer and An Electron Acceptor?
-
Arkhipov, V. I.; Heremans, P.; Bässler, H. Why Is Exciton Dissociation So Efficient At The Interface Between A Conjugated Polymer And An Electron Acceptor? Appl. Phys. Lett. 2003, 82, 4605-4607
-
(2003)
Appl. Phys. Lett.
, vol.82
, pp. 4605-4607
-
-
Arkhipov, V.I.1
Heremans, P.2
Bässler, H.3
-
15
-
-
5744248609
-
Separation of Geminate Charge-Pairs at Donor-Acceptor Interfaces in Disordered Solids
-
Peumans, P.; Forrest, S. R. Separation Of Geminate Charge-Pairs At Donor-Acceptor Interfaces In Disordered Solids Chem. Phys. Lett. 2004, 398, 27-31
-
(2004)
Chem. Phys. Lett.
, vol.398
, pp. 27-31
-
-
Peumans, P.1
Forrest, S.R.2
-
16
-
-
57849118804
-
Free Energy Control of Charge Photogeneration in Polythiophene/Fullerene Solar Cells: The Influence of Thermal Annealing on P3HT/PCBM Blends
-
Clarke, T. M.; Ballantyne, A. M.; Nelson, J.; Bradley, D. D. C.; Durrant, J. R. Free Energy Control of Charge Photogeneration in Polythiophene/Fullerene Solar Cells: The Influence of Thermal Annealing on P3HT/PCBM Blends Adv. Funct. Mater. 2008, 18, 4029-4035
-
(2008)
Adv. Funct. Mater.
, vol.18
, pp. 4029-4035
-
-
Clarke, T.M.1
Ballantyne, A.M.2
Nelson, J.3
Bradley, D.D.C.4
Durrant, J.R.5
-
17
-
-
41449090763
-
Charge Carrier Formation in Polythiophene/Fullerene Blend Films Studied by Transient Absorption Spectroscopy
-
Ohkita, H.; Cook, S.; Astuti, Y.; Duffy, W.; Tierney, S.; Zhang, W.; Heeney, M.; McCulloch, I.; Nelson, J.; Bradley, D. D. C. Charge Carrier Formation in Polythiophene/Fullerene Blend Films Studied by Transient Absorption Spectroscopy J. Am. Chem. Soc. 2008, 130, 3030-3042
-
(2008)
J. Am. Chem. Soc.
, vol.130
, pp. 3030-3042
-
-
Ohkita, H.1
Cook, S.2
Astuti, Y.3
Duffy, W.4
Tierney, S.5
Zhang, W.6
Heeney, M.7
McCulloch, I.8
Nelson, J.9
Bradley, D.D.C.10
-
18
-
-
45249122965
-
Compositional and Electric Field Dependence of the Dissociation of Charge Transfer Excitons in Alternating Polyfluorene Copolymer/Fullerene Blends
-
Veldman, D.; Ipek, O.; Meskers, S. C. J.; Sweelssen, J.; Koetse, M. M.; Veenstra, S. C.; Kroon, J. M.; van Bavel, S. S.; Loos, J.; Janssen, R. A. J. Compositional and Electric Field Dependence of the Dissociation of Charge Transfer Excitons in Alternating Polyfluorene Copolymer/Fullerene Blends J. Am. Chem. Soc. 2008, 130, 7721-7735
-
(2008)
J. Am. Chem. Soc.
, vol.130
, pp. 7721-7735
-
-
Veldman, D.1
Ipek, O.2
Meskers, S.C.J.3
Sweelssen, J.4
Koetse, M.M.5
Veenstra, S.C.6
Kroon, J.M.7
Van Bavel, S.S.8
Loos, J.9
Janssen, R.A.J.10
-
19
-
-
84871291914
-
Hot Charge-Transfer Excitons Set the Time Limit for Charge Separation at Donor/Acceptor Interfaces in Organic Photovoltaics
-
Jailaubekov, A. E.; Willard, A. P.; Tritsch, J. R.; Chan, W-L; Sai, N.; Gearba, R.; Kaake1, L. G.; Williams, K. J.; Leung, K.; Rossky, P. J. Hot Charge-Transfer Excitons Set The Time Limit For Charge Separation At Donor/Acceptor Interfaces In Organic Photovoltaics Nat. Mater. 2012, 12, 66-73
-
(2012)
Nat. Mater.
, vol.12
, pp. 66-73
-
-
Jailaubekov, A.E.1
Willard, A.P.2
Tritsch, J.R.3
Chan, W.-L.4
Sai, N.5
Gearba, R.6
Kaake, L.G.7
Williams, K.J.8
Leung, K.9
Rossky, P.J.10
-
20
-
-
84871327002
-
Hot Exciton Dissociation in Polymer Solar Cells
-
Grancini, G.; Maiuri, M.; Fazzi, D.; Petrozza, A.; Egelhaaf, H.-J.; Brida, D.; Cerullo, G.; Lanzani, G. Hot Exciton Dissociation In Polymer Solar Cells Nat. Mater. 2012, 12, 29
-
(2012)
Nat. Mater.
, vol.12
, pp. 29
-
-
Grancini, G.1
Maiuri, M.2
Fazzi, D.3
Petrozza, A.4
Egelhaaf, H.-J.5
Brida, D.6
Cerullo, G.7
Lanzani, G.8
-
21
-
-
84858341576
-
The Role of Driving Energy and Delocalized States for Charge Separation in Organic Semiconductors
-
Bakulin, A. A.; Rao, A.; Pavelyev, V. G.; van Loosdrecht, P. H. M.; Pshenichnikov, M. S.; Niedzialek, D.; Cornil, J.; Beljonne, D.; Friend, R. H. The Role of Driving Energy and Delocalized States for Charge Separation in Organic Semiconductors Science 2012, 335, 1340-1344
-
(2012)
Science
, vol.335
, pp. 1340-1344
-
-
Bakulin, A.A.1
Rao, A.2
Pavelyev, V.G.3
Van Loosdrecht, P.H.M.4
Pshenichnikov, M.S.5
Niedzialek, D.6
Cornil, J.7
Beljonne, D.8
Friend, R.H.9
-
22
-
-
80455137787
-
Spontaneous Charge Transfer and Dipole Formation at the Interface between P3HT and PCBM
-
Aarnio, H.; Sehati, P.; Braun, S.; Nyman, M.; de Jong, M. P.; Fahlman, M.; Österbacka, R. Spontaneous Charge Transfer and Dipole Formation at the Interface Between P3HT and PCBM Adv. Energy Mater. 2011, 1, 792-797
-
(2011)
Adv. Energy Mater.
, vol.1
, pp. 792-797
-
-
Aarnio, H.1
Sehati, P.2
Braun, S.3
Nyman, M.4
De Jong, M.P.5
Fahlman, M.6
Österbacka, R.7
-
23
-
-
79952170702
-
Design of Organic Semiconductors from Molecular Electrostatics
-
Heimel, G.; Salzmann, I.; Duhm, S.; Koch, N. Design of Organic Semiconductors from Molecular Electrostatics Chem. Mater. 2011, 23, 359-377
-
(2011)
Chem. Mater.
, vol.23
, pp. 359-377
-
-
Heimel, G.1
Salzmann, I.2
Duhm, S.3
Koch, N.4
-
24
-
-
0011336568
-
Energy Level Alignment and Interfacial Electronic Structures at Organic/Metal and Organic/Organic Interfaces
-
Ishii, H.; Sugiyama, K.; Ito, E.; Seki, K. Energy Level Alignment and Interfacial Electronic Structures at Organic/Metal and Organic/Organic Interfaces Adv. Mater. 1999, 11, 605-625
-
(1999)
Adv. Mater.
, vol.11
, pp. 605-625
-
-
Ishii, H.1
Sugiyama, K.2
Ito, E.3
Seki, K.4
-
25
-
-
37149018942
-
Formation of the Interfacial Dipole at Organic-Organic Interfaces: C60/Polymer Interfaces
-
Osikowicz, W.; de Jong, M. P.; Salaneck, W. R. Formation of the Interfacial Dipole at Organic-Organic Interfaces: C60/Polymer Interfaces Adv. Mater. 2007, 19, 4213-4217
-
(2007)
Adv. Mater.
, vol.19
, pp. 4213-4217
-
-
Osikowicz, W.1
De Jong, M.P.2
Salaneck, W.R.3
-
26
-
-
33847045616
-
Formation of a Ground-State Charge-Transfer Complex in Polyfluorene/[6,6]-Phenyl-C61 Butyric Acid Methyl Ester (PCBM) Blend Films and Its Role in the Function of Polymer/PCBM Solar Cells
-
Benson-Smith, J. J.; Goris, L.; Vandewal, K.; Haenen, K.; Manca, J. V.; Vanderzande, D.; Bradley, D. C. C.; Nelson, J. Formation of a Ground-State Charge-Transfer Complex in Polyfluorene/[6,6]-Phenyl-C61 Butyric Acid Methyl Ester (PCBM) Blend Films and Its Role in the Function of Polymer/PCBM Solar Cells Adv. Funct. Mater. 2007, 17, 451-457
-
(2007)
Adv. Funct. Mater.
, vol.17
, pp. 451-457
-
-
Benson-Smith, J.J.1
Goris, L.2
Vandewal, K.3
Haenen, K.4
Manca, J.V.5
Vanderzande, D.6
Bradley, D.C.C.7
Nelson, J.8
-
27
-
-
84864762143
-
Influence of Photon Excess Energy on Charge Carrier Dynamics in a Polymer-Fullerene Solar Cell
-
Van der Hofstad, T. G. J.; Di Nuzzo, D.; Van der Berg, M.; Janssen, R. A. J.; Meskers, S. C. J. Influence of Photon Excess Energy on Charge Carrier Dynamics in a Polymer-Fullerene Solar Cell Adv. Energy Mater. 2012, 2, 1095-1099
-
(2012)
Adv. Energy Mater.
, vol.2
, pp. 1095-1099
-
-
Van Der Hofstad, T.G.J.1
Di Nuzzo, D.2
Van Der Berg, M.3
Janssen, R.A.J.4
Meskers, S.C.J.5
-
28
-
-
84860380166
-
Mechanism of Mobile Charge Carrier Generation in Blends of Conjugated Polymers and Fullerenes: Significance of Charge Delocalization and Excess Free Energy
-
Murthy, D. H. K.; Gao, M.; Vermeulen, M. J. W.; Siebbeles, L. D. A.; Savenije, T. J. Mechanism of Mobile Charge Carrier Generation in Blends of Conjugated Polymers and Fullerenes: Significance of Charge Delocalization and Excess Free Energy J. Phys. Chem. C 2012, 116, 9214-9220
-
(2012)
J. Phys. Chem. C
, vol.116
, pp. 9214-9220
-
-
Murthy, D.H.K.1
Gao, M.2
Vermeulen, M.J.W.3
Siebbeles, L.D.A.4
Savenije, T.J.5
-
29
-
-
68749110883
-
Origin of the Efficient Polaron-Pair Dissociation in Polymer-Fullerene Blends
-
Deibel, C.; Strobel, T.; Dyakonov, V. Origin of the Efficient Polaron-Pair Dissociation in Polymer-Fullerene Blends Phys. Rev. Lett. 2009, 103, 036402
-
(2009)
Phys. Rev. Lett.
, vol.103
, pp. 036402
-
-
Deibel, C.1
Strobel, T.2
Dyakonov, V.3
-
30
-
-
73849121084
-
Charge Carrier Dissociation and Recombination in Polymer Solar Cells
-
Deibel, C. Charge Carrier Dissociation and Recombination in Polymer Solar Cells Phys. Status Solidi A 2009, 206, 2731-2736
-
(2009)
Phys. Status Solidi A
, vol.206
, pp. 2731-2736
-
-
Deibel, C.1
-
31
-
-
80455158185
-
Why Holes and Electrons Separate so Well in Polymer/Fullerene Photovoltaic Cells
-
McMahon, D. P.; Cheung, D. L.; Troisi, A. Why Holes and Electrons Separate So Well in Polymer/Fullerene Photovoltaic Cells J. Phys. Chem. Lett. 2011, 2, 2737-2741
-
(2011)
J. Phys. Chem. Lett.
, vol.2
, pp. 2737-2741
-
-
McMahon, D.P.1
Cheung, D.L.2
Troisi, A.3
-
32
-
-
84865293755
-
Long-range Exciton Dissociation in Organic Solar Cells
-
Caruso, D.; Troisi, A. Long-range Exciton Dissociation in Organic Solar Cells Proc. Natl. Acad. Sci. U.S.A. 2012, 109, 13498-13503
-
(2012)
Proc. Natl. Acad. Sci. U.S.A.
, vol.109
, pp. 13498-13503
-
-
Caruso, D.1
Troisi, A.2
-
33
-
-
79952144538
-
Electronic Processes at Organic-Organic Interfaces: Insight from Modeling and Implications for Opto-electronic Devices
-
Beljonne, D.; Cornil, J.; Muccioli, L.; Zannoni, C.; Brédas, J.-L.; Castet, F. Electronic Processes at Organic-Organic Interfaces: Insight from Modeling and Implications for Opto-electronic Devices Chem. Mater. 2011, 23, 591-609
-
(2011)
Chem. Mater.
, vol.23
, pp. 591-609
-
-
Beljonne, D.1
Cornil, J.2
Muccioli, L.3
Zannoni, C.4
Brédas, J.-L.5
Castet, F.6
-
34
-
-
33746347382
-
New-Generation Amber United-Atom Force Field
-
Yang, L.; Tan, C.; Hsieh, M.-J.; Wang, J.; Duan, Y.; Cieplak, P.; Caldwell, J.; Kollman, P. A.; Luo, R. New-Generation Amber United-Atom Force Field J. Phys. Chem. B 2006, 110, 13166-13176
-
(2006)
J. Phys. Chem. B
, vol.110
, pp. 13166-13176
-
-
Yang, L.1
Tan, C.2
Hsieh, M.-J.3
Wang, J.4
Duan, Y.5
Cieplak, P.6
Caldwell, J.7
Kollman, P.A.8
Luo, R.9
-
35
-
-
84986492477
-
Atomic Charges Derived from Semiempirical Methods
-
Besler, B. H.; Merz, K. M., Jr; Kollman, P. A. Atomic Charges Derived from Semiempirical Methods J. Comput. Chem. 1990, 11, 431-439
-
(1990)
J. Comput. Chem.
, vol.11
, pp. 431-439
-
-
Besler, B.H.1
Merz Jr., K.M.2
Kollman, P.A.3
-
36
-
-
27344436659
-
Scalable Molecular Dynamics with NAMD
-
Phillips, J. C.; Braun, R.; Wang, W.; Gumbart, J.; Tajkhorshid, E.; Villa, E.; Chipot, C.; Skeel, R. D.; Kale, L.; Schulten, K. Scalable Molecular Dynamics with NAMD J. Comput. Chem. 2005, 26, 1781-1802
-
(2005)
J. Comput. Chem.
, vol.26
, pp. 1781-1802
-
-
Phillips, J.C.1
Braun, R.2
Wang, W.3
Gumbart, J.4
Tajkhorshid, E.5
Villa, E.6
Chipot, C.7
Skeel, R.D.8
Kale, L.9
Schulten, K.10
-
37
-
-
33645961739
-
A Smooth Particle Mesh Ewald Method
-
Essmann, U.; Perera, L.; Berkowitz, M. L.; Darden, T.; Lee, H.; Pederson, L. A Smooth Particle Mesh Ewald Method J. Chem. Phys. 1995, 103, 8577-8593
-
(1995)
J. Chem. Phys.
, vol.103
, pp. 8577-8593
-
-
Essmann, U.1
Perera, L.2
Berkowitz, M.L.3
Darden, T.4
Lee, H.5
Pederson, L.6
-
38
-
-
54949106206
-
Simultaneous Use of Small- and Wide-Angle X-ray Techniques to Analyze Nanometerscale Phase Separation in Polymer Heterojunction Solar Cells
-
Chiu, M. Y.; Jeng, U.-S.; Su, C. H.; Liang, K. S.; Wei, K.-H. Simultaneous Use of Small- and Wide-Angle X-ray Techniques to Analyze Nanometerscale Phase Separation in Polymer Heterojunction Solar Cells Adv. Mater. 2008, 20, 2573-2578
-
(2008)
Adv. Mater.
, vol.20
, pp. 2573-2578
-
-
Chiu, M.Y.1
Jeng, U.-S.2
Su, C.H.3
Liang, K.S.4
Wei, K.-H.5
-
39
-
-
84978058743
-
Microscopic Dielectric Theory for Molecular Crystals
-
Munn, R. W. Microscopic Dielectric Theory for Molecular Crystals Chem. Phys. 1980, 50, 119-126
-
(1980)
Chem. Phys.
, vol.50
, pp. 119-126
-
-
Munn, R.W.1
-
40
-
-
0003966674
-
-
AIP: NewYork, and references therein
-
Silinsh, E. A.; Čápek, V. Organic Molecular Crystals: Interaction, Localization, and Transport Phenomena; AIP: NewYork, 1994; and references therein.
-
(1994)
Organic Molecular Crystals: Interaction, Localization, and Transport Phenomena
-
-
Silinsh, E.A.1
Čápek, V.2
-
41
-
-
41549128002
-
Electronic Polarization Effects on Charge Carriers in Anthracene: A Valence Bond Study
-
Castet, F.; Aurel, P.; Fritsch, A.; Ducasse, L.; Liotard, D.; Linares, M.; Cornil, J.; Beljonne, D. Electronic Polarization Effects on Charge Carriers in Anthracene: A Valence Bond Study Phys. Rev. B 2008, 77, 115210-1-115210-14
-
(2008)
Phys. Rev. B
, vol.77
, pp. 1152101-11521014
-
-
Castet, F.1
Aurel, P.2
Fritsch, A.3
Ducasse, L.4
Liotard, D.5
Linares, M.6
Cornil, J.7
Beljonne, D.8
-
42
-
-
0141676351
-
Electronic Polarization in Pentacene Crystals and Thin Films
-
Tsiper, E. V.; Soos, Z. G. Electronic Polarization in Pentacene Crystals and Thin Films Phys. Rev. B 2003, 68, 085301-1-085301-10
-
(2003)
Phys. Rev. B
, vol.68
, pp. 0853011-08530110
-
-
Tsiper, E.V.1
Soos, Z.G.2
-
43
-
-
0035891423
-
Charge Redistribution and Polarization Energy of Organic Molecular Crystals
-
Tsiper, E. V.; Soos, Z. G. Charge Redistribution and Polarization Energy of Organic Molecular Crystals Phys. Rev. B 2001, 64, 195124-1-195124-12
-
(2001)
Phys. Rev. B
, vol.64
, pp. 1951241-19512412
-
-
Tsiper, E.V.1
Soos, Z.G.2
-
44
-
-
33947091822
-
Atom Dipole Interaction Model for Molecular Polarizability. Application to Polyatomic Molecules and Determination of Atom Polarizabilities
-
Applequist, J.; Carl, J. R.; Fung, J. K. Atom Dipole Interaction Model for Molecular Polarizability. Application to Polyatomic Molecules and Determination of Atom Polarizabilities J. Am. Chem. Soc. 1972, 94, 2952-2960
-
(1972)
J. Am. Chem. Soc.
, vol.94
, pp. 2952-2960
-
-
Applequist, J.1
Carl, J.R.2
Fung, J.K.3
-
45
-
-
0000161809
-
Molecular Polarizabilities Calculated with a Modified Dipole Interaction
-
Thole, B. T. Molecular Polarizabilities Calculated with a Modified Dipole Interaction Chem. Phys. 1981, 59, 341-350
-
(1981)
Chem. Phys.
, vol.59
, pp. 341-350
-
-
Thole, B.T.1
-
46
-
-
77749298172
-
Current Status of the AMOEBA Polarizable Force Field
-
Ponder, J. W.; Wu, C.; Ren, P.; Pande, V. S.; Chodera, J. D.; Schnieders, M. J.; Haque, I.; Mobley, D. L.; Lambrecht, D. S.; Di Stasio, R. A. Current Status of the AMOEBA Polarizable Force Field J. Phys. Chem. B 2010, 114, 2549-2564
-
(2010)
J. Phys. Chem. B
, vol.114
, pp. 2549-2564
-
-
Ponder, J.W.1
Wu, C.2
Ren, P.3
Pande, V.S.4
Chodera, J.D.5
Schnieders, M.J.6
Haque, I.7
Mobley, D.L.8
Lambrecht, D.S.9
Di Stasio, R.A.10
-
47
-
-
33645716062
-
Strike a Balance: Optimization of Backbone Torsion Parameters of Amber Polarizable Force Field for Simulations of Proteins and Peptides
-
Wang, Z.-X.; Zhang, W.; Wu, C.; Lei, H.; Cieplak, P.; Duan, Y. Strike a Balance: Optimization of Backbone Torsion Parameters of Amber Polarizable Force Field for Simulations of Proteins and Peptides J. Comput. Chem. 2006, 27, 781-790
-
(2006)
J. Comput. Chem.
, vol.27
, pp. 781-790
-
-
Wang, Z.-X.1
Zhang, W.2
Wu, C.3
Lei, H.4
Cieplak, P.5
Duan, Y.6
-
48
-
-
70450206724
-
-
Revision A.1. Gaussian, Inc. Wallingford, CT
-
Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Scalmani, G.; Barone, V.; Mennucci, B.; Petersson, G. A.; Nakatsuji, H.; Caricato, M.; Li, X.; Hratchian, H. P.; Izmaylov, A. F.; Bloino, J.; Zheng, G.; Sonnenberg, J. L.; Hada, M.; Ehara, M.; Toyota, K.; Fukuda, R.; Hasegawa, J.; Ishida, M.; Nakajima, T.; Honda, Y.; Kitao, O.; Nakai, H.; Vreven, T.; Montgomery, J. A., Jr.; Peralta, J. E.; Ogliaro, F.; Bearpark, M.; Heyd, J. J.; Brothers, E.; Kudin, K. N.; Staroverov, V. N.; Kobayashi, R.; Normand, J.; Raghavachari, K.; Rendell, A.; Burant, J. C.; Iyengar, S. S.; Tomasi, J.; Cossi, M.; Rega, N.; Millam, N. J.; Klene, M.; Knox, J. E.; Cross, J. B.; Bakken, V.; Adamo, C.; Jaramillo, J.; Gomperts, R.; Stratmann, R. E.; Yazyev, O.; Austin, A. J.; Cammi, R.; Pomelli, C.; Ochterski, J. W.; Martin, R. L.; Morokuma, K.; Zakrzewski, V. G.; Voth, G. A.; Salvador, P.; Dannenberg, J. J.; Dapprich, S.; Daniels, A. D.; Farkas, O.; Foresman, J. B.; Ortiz, J. V.; Cioslowski, J.; Fox, D. J. Gaussian 09, Revision A.1; Gaussian, Inc.; Wallingford, CT, 2009.
-
(2009)
Gaussian 09
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
Scuseria, G.E.4
Robb, M.A.5
Cheeseman, J.R.6
Scalmani, G.7
Barone, V.8
Mennucci, B.9
Petersson, G.A.10
Nakatsuji, H.11
Caricato, M.12
Li, X.13
Hratchian, H.P.14
Izmaylov, A.F.15
Bloino, J.16
Zheng, G.17
Sonnenberg, J.L.18
Hada, M.19
Ehara, M.20
Toyota, K.21
Fukuda, R.22
Hasegawa, J.23
Ishida, M.24
Nakajima, T.25
Honda, Y.26
Kitao, O.27
Nakai, H.28
Vreven, T.29
Montgomery Jr., J.A.30
Peralta, J.E.31
Ogliaro, F.32
Bearpark, M.33
Heyd, J.J.34
Brothers, E.35
Kudin, K.N.36
Staroverov, V.N.37
Kobayashi, R.38
Normand, J.39
Raghavachari, K.40
Rendell, A.41
Burant, J.C.42
Iyengar, S.S.43
Tomasi, J.44
Cossi, M.45
Rega, N.46
Millam, N.J.47
Klene, M.48
Knox, J.E.49
Cross, J.B.50
Bakken, V.51
Adamo, C.52
Jaramillo, J.53
Gomperts, R.54
Stratmann, R.E.55
Yazyev, O.56
Austin, A.J.57
Cammi, R.58
Pomelli, C.59
Ochterski, J.W.60
Martin, R.L.61
Morokuma, K.62
Zakrzewski, V.G.63
Voth, G.A.64
Salvador, P.65
Dannenberg, J.J.66
Dapprich, S.67
Daniels, A.D.68
Farkas, O.69
Foresman, J.B.70
Ortiz, J.V.71
Cioslowski, J.72
Fox, D.J.73
more..
-
49
-
-
0002317344
-
-
Luckhurst, G. R. Gray, G. W. Academic Press: London, Chapter 3
-
Zannoni, C., in The Molecular Physics of Liquid Crystals, Luckhurst, G. R.;; Gray, G. W., Eds.; Academic Press: London, 1979; Chapter 3, pp 51-83.
-
(1979)
The Molecular Physics of Liquid Crystals
, pp. 51-83
-
-
Zannoni, C.1
-
50
-
-
80054708208
-
Simulation of Vapor-Phase Deposition and Growth of a Pentacene Thin Film on C60 (001)
-
Muccioli, L.; D'Avino, G.; Zannoni, C. Simulation of Vapor-Phase Deposition and Growth of a Pentacene Thin Film on C60 (001) Adv. Mater. 2011, 23, 4532-4536
-
(2011)
Adv. Mater.
, vol.23
, pp. 4532-4536
-
-
Muccioli, L.1
D'Avino, G.2
Zannoni, C.3
-
51
-
-
72649100272
-
Electronic Structure and Geminate Pair Energetics at Organic-Organic Interfaces: The Case of Pentacene/ C60 Heterojunctions
-
Verlaak, S.; Beljonne, D.; Cheyns, D.; Rolin, C.; Linares, M.; Castet, F.; Cornil, J.; Heremans, P. Electronic Structure and Geminate Pair Energetics at Organic-Organic Interfaces: The Case of Pentacene/ C60 Heterojunctions Adv. Funct. Mater. 2009, 19, 3809-3814
-
(2009)
Adv. Funct. Mater.
, vol.19
, pp. 3809-3814
-
-
Verlaak, S.1
Beljonne, D.2
Cheyns, D.3
Rolin, C.4
Linares, M.5
Castet, F.6
Cornil, J.7
Heremans, P.8
-
52
-
-
77649129684
-
On the Interface Dipole at the Pentacene-Fullerene Heterojunction: A Theoretical Study
-
Linares, M.; Beljonne, D.; Cornil, J.; Lancaster, K.; Brédas, J. L.; Verlaak, S.; Mityashin, A.; Heremans, P.; Fuchs, A.; Lennartz, C.; Idé, J.; Méreau, R.; Aurel, P.; Ducasse, L.; Castet, F. On the Interface Dipole at the Pentacene-Fullerene Heterojunction: A Theoretical Study J. Phys. Chem. C 2010, 114, 3215-3224
-
(2010)
J. Phys. Chem. C
, vol.114
, pp. 3215-3224
-
-
Linares, M.1
Beljonne, D.2
Cornil, J.3
Lancaster, K.4
Brédas, J.L.5
Verlaak, S.6
Mityashin, A.7
Heremans, P.8
Fuchs, A.9
Lennartz, C.10
Idé, J.11
Méreau, R.12
Aurel, P.13
Ducasse, L.14
Castet, F.15
-
53
-
-
84865984580
-
Tuning the Interfacial Electronic Structure at Organic Heterojunctions by Chemical Design
-
Mothy, S.; Guillaume, M.; Idé, J.; Castet, F.; Ducasse, L.; Cornil, J.; Beljonne, D. Tuning the Interfacial Electronic Structure at Organic Heterojunctions by Chemical Design J. Phys. Chem. Lett. 2012, 3, 2374-2378
-
(2012)
J. Phys. Chem. Lett.
, vol.3
, pp. 2374-2378
-
-
Mothy, S.1
Guillaume, M.2
Idé, J.3
Castet, F.4
Ducasse, L.5
Cornil, J.6
Beljonne, D.7
-
54
-
-
84872958002
-
Interfacial Dipole and Band Bending in Model Pentacene/C60 Heterojunctions
-
Idé, J.; Mothy, S.; Savoyant, A.; Fritsch, A.; Aurel, P.; Méreau, R.; Ducasse, L.; Cornil, J.; Beljonne, D.; Castet, F. Interfacial Dipole and Band Bending in Model Pentacene/C60 Heterojunctions Int. J. Quantum Chem. 2013, 113, 580-584
-
(2013)
Int. J. Quantum Chem.
, vol.113
, pp. 580-584
-
-
Idé, J.1
Mothy, S.2
Savoyant, A.3
Fritsch, A.4
Aurel, P.5
Méreau, R.6
Ducasse, L.7
Cornil, J.8
Beljonne, D.9
Castet, F.10
-
55
-
-
72849110305
-
Charge Transfer Excitons in Polymer/Fullerene Blends: The Role of Morphology and Polymer Chain Conformation
-
Hallermann, M.; Kriegel, I.; Da Como, E.; von Hauff, E.; Feldmann, J. Charge Transfer Excitons in Polymer/Fullerene Blends: The Role of Morphology and Polymer Chain Conformation Adv. Funct. Mater. 2009, 19, 3662-3668
-
(2009)
Adv. Funct. Mater.
, vol.19
, pp. 3662-3668
-
-
Hallermann, M.1
Kriegel, I.2
Da Como, E.3
Von Hauff, E.4
Feldmann, J.5
-
56
-
-
84855661513
-
Fullerene Crystallisation as a Key Driver of Charge Separation in Polymer/Fullerene Bulk Heterojunction Solar Cells
-
Jamieson, F. C.; Buchaca Domingo, E.; McCarthy-Ward, T.; Heeney, M.; Stingelin, N.; Durrant, J. R. Fullerene Crystallisation as a Key Driver of Charge Separation in Polymer/Fullerene Bulk Heterojunction Solar Cells Chem. Sci. 2012, 3, 485
-
(2012)
Chem. Sci.
, vol.3
, pp. 485
-
-
Jamieson, F.C.1
Buchaca Domingo, E.2
McCarthy-Ward, T.3
Heeney, M.4
Stingelin, N.5
Durrant, J.R.6
-
57
-
-
68249090508
-
Solution-processable polymer solar cells from a poly(3-hexylthiophene)/ [6,6]-phenyl C61-butyric acidmethyl ester concentration graded bilayers
-
Wang, D. H.; Lee, H. K.; Choi, D.-G.; Park, J. H.; Park, O. O. Solution-processable polymer solar cells from a poly(3-hexylthiophene)/[6,6]- phenyl C61-butyric acidmethyl ester concentration graded bilayers Appl. Phys. Lett. 2009, 95, 043505-1-043505-3
-
(2009)
Appl. Phys. Lett.
, vol.95
, pp. 0435051-0435053
-
-
Wang, D.H.1
Lee, H.K.2
Choi, D.-G.3
Park, J.H.4
Park, O.O.5
-
58
-
-
77951681132
-
Charge Generation and Recombination Dynamics in Poly(3-hexylthiophene)/ Fullerene Blend Films with Different Regioregularities and Morphologies
-
Guo, J. M.; Ohkita, H.; Benten, H.; Ito, S. Charge Generation and Recombination Dynamics in Poly(3-hexylthiophene)/Fullerene Blend Films with Different Regioregularities and Morphologies J. Am. Chem. Soc. 2010, 132, 6154-6164
-
(2010)
J. Am. Chem. Soc.
, vol.132
, pp. 6154-6164
-
-
Guo, J.M.1
Ohkita, H.2
Benten, H.3
Ito, S.4
-
59
-
-
84863678943
-
Mechanism for Efficient Photoinduced Charge Separation at Disordered Organic Heterointerfaces
-
van Eersel, H.; Janssen, R. A. J.; Kemerink, M. Mechanism for Efficient Photoinduced Charge Separation at Disordered Organic Heterointerfaces Adv. Funct. Mater. 2012, 22, 2700-2708
-
(2012)
Adv. Funct. Mater.
, vol.22
, pp. 2700-2708
-
-
Van Eersel, H.1
Janssen, R.A.J.2
Kemerink, M.3
|