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Research Output 1986 2019

2019

Charge and exciton transport in organic semiconductors: the role of molecular vibrations

de Vries, X., 18 Sep 2019, Eindhoven: Technische Universiteit Eindhoven. 155 p.

Research output: ThesisPhd Thesis 1 (Research TU/e / Graduation TU/e)Academic

Open Access
File
1 Citation (Scopus)

Effect of exciton diffusion on the triplet-triplet annihilation rate in organic semiconductor host-guest systems

Coehoorn, R., Bobbert, P. A. & van Eersel, H., 7 Jan 2019, In : Physical Review B. 99, 2, 10 p., 024201

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
Semiconducting organic compounds
organic semiconductors
Excitons
excitons
radii
2 Citations (Scopus)

Equilibrated charge carrier populations govern steady-state nongeminate recombination in disordered organic solar cells

Roland, S., Kniepert, J., Love, J. A., Negi, V., Liu, F., Bobbert, P., Melianas, A., Kemerink, M., Hofacker, A. & Neher, D., 21 Mar 2019, In : The Journal of Physical Chemistry Letters. 10, 6, p. 1374-1381 8 p.

Research output: Contribution to journalArticleAcademicpeer-review

Charge carriers
charge carriers
solar cells
Fullerenes
Open circuit voltage

Short-channel vertical organic field-effect transistors with high on/off ratios

Dogan, T., Verbeek, R., Kronemeijer, A. J., Bobbert, P. A., Gelinck, G. H. & van der Wiel, W. G., 1 May 2019, In : Advanced Electronic Materials. 5, 5, 1900041

Research output: Contribution to journalArticleAcademicpeer-review

Organic field effect transistors
Current density
Semiconducting polymers
Silicon
Electric space charge

Triplet exciton diffusion in metalorganic phosphorescent host-guest systems from first principles

de Vries, X., Friederich, P., Wenzel, W., Coehoorn, R. & Bobbert, P. A., 13 May 2019, In : Physical Review B. 99, 20, 12 p., 205201

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
Excitons
excitons
diffusion length
emitters
Organic light emitting diodes (OLED)
2018

Accurate and efficient band gap predictions of metal halide perovskites using the DFT-1/2 method : GW accuracy with DFT expense

Tao, S. X., Cao, X. & Bobbert, P. A., 2018, Proceedings of International Conference on Perovskite Thin Film Photovoltaics, Photonics and Optoelectronics (ABXPV18PEROPTO). p. 1-9

Research output: Chapter in Book/Report/Conference proceedingConference contributionAcademic

Open Access
File

Atomistic view of interstitial occupation of small alkali cations in Perovskites and its impact on ion migration

Tao, S. X., Cao, J., Zhao, N. & Bobbert, P. A., 2018, Proceedings of International Conference on Perovskite Thin Film Photovoltaics, Photonics and Optoelectronics (ABXPV18PEROPTO).

Research output: Chapter in Book/Report/Conference proceedingConference contributionAcademic

Alkalies
Cations
Ions
Monovalent Cations
Density functional theory
8 Citations (Scopus)

Effect of triplet confinement on triplet–triplet annihilation in organic phosphorescent host–guest systems

Ligthart, A., de Vries, X., Zhang, L., Pols, M. C. W. M., Bobbert, P. A., van Eersel, H. & Coehoorn, R., 27 Dec 2018, In : Advanced Functional Materials. 28, 52, 10 p., 1804618

Research output: Contribution to journalArticleAcademicpeer-review

Excitons
excitons
Molecules
molecules
Organic light emitting diodes (OLED)

Exploring the process-structure-property relationship of organic solar cells by high performance computer simulations

Negi, V., 26 Sep 2018, Eindhoven: Technische Universiteit Eindhoven. 161 p.

Research output: ThesisPhd Thesis 1 (Research TU/e / Graduation TU/e)Academic

Open Access
File
10 Citations (Scopus)

Full quantum treatment of charge dynamics in amorphous molecular semiconductors

de Vries, X., Friederich, P., Wenzel, W., Coehoorn, R. & Bobbert, P. A., 12 Feb 2018, In : Physical Review B. 97, 7, 10 p., 075203

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
Charge transfer
Semiconductor materials
Organic light emitting diodes (OLED)
Electrons
light emitting diodes

Influence of ion-exchange on lead-free inorganic Sn halide Perovskites

Jiang, J., Bobbert, P. A. & Tao, S. X., 2018, Proceedings of International Conference on Perovskite Thin Film Photovoltaics, Photonics and Optoelectronics (ABXPV18PEROPTO) 2018.

Research output: Chapter in Book/Report/Conference proceedingConference contributionAcademic

Ion exchange
Anions
Cations
Substitution reactions
Solar absorbers
23 Citations (Scopus)

Interstitial occupancy by extrinsic alkali cations in Perovskites and its impact on ion migration

Cao, J., Tao, S., Bobbert, P. A., Wong, C-P. & Zhao, N., 2018, In : Advanced Materials. 30, 9 p., 1707350

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
Alkalies
Perovskite
Cations
Positive ions
Ions
3 Citations (Scopus)

Simulating phase separation during spin coating of a polymer–fullerene blend: a joint computational and experimental investigation

Negi, V., Wodo, O., van Franeker, J. J., Janssen, R. A. J. & Bobbert, P. A., 26 Feb 2018, In : ACS Applied Energy Materials. 1, 2, p. 725-735 11 p.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
fullerenes
coating
polymers
drying
evaporation
6 Citations (Scopus)

Stabilizing lead-free all-inorganic tin halide Perovskites by ion exchange

Jiang, J., Onwudinanti, C., Hatton, R. A., Bobbert, P. A. & Tao, S., 2018, In : Journal of Physical Chemistry C. 122, 31, p. 17660-17667

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
Tin
perovskites
halides
tin
Ion exchange

Stabilizing lead-free all-inorganic tin halide Perovskites by ion exchange

Jiang, J., Onwudinanti, C., Hatton, R., Bobbert, P. A. & Tao, S. X., 2018, Proceedings of International Conference on Hybrid and Organic Photovoltaics (HOPV18).

Research output: Chapter in Book/Report/Conference proceedingConference contributionAcademic

Tin
Ion exchange
Solar cells
Substitution reactions
Air
Open Access
File
organic semiconductors
semiconductor devices
low voltage
charge carriers
simulation
2017

Accurate and efficient band gap predictions of metal halide perovskites using DFT-1/2 methods: GW accuracy with DFT expense

Tao, S. X., Cao, X. & Bobbert, P. A., 2017, Computational Sciences for Future Energy Conference 2017. p. 1-9

Research output: Chapter in Book/Report/Conference proceedingConference contributionAcademic

Open Access
File

Accurate and efficient band gap predictions of metal halide perovskites using DFT-1/2 methods: GW accuracy with DFT expense

Tao, S. X., Cao, X. & Bobbert, P. A., 2017, International Conference of the Next Generation III PV Materials 2017. p. 1-9

Research output: Chapter in Book/Report/Conference proceedingConference contributionAcademic

Open Access
File

Accurate and efficient band gap predictions of metal halide perovskites using DFT-1/2 methods : GW accuracy with DFT expense

Tao, S. X., Cao, X. & Bobbert, P. A., 2017, Dutch Hybrid Perovskites Workshop 2017, 6 July 2017, Groningen, The Netherlands. p. 1-9

Research output: Chapter in Book/Report/Conference proceedingConference contributionAcademic

Open Access
File
33 Citations (Scopus)

Accurate and efficient band gap predictions of metal halide perovskites using the DFT-1/2 method: GW accuracy with DFT expense

Tao, S., Cao, X. & Bobbert, P. A., 1 Dec 2017, In : Scientific Reports. 7, 1, 9 p., 14386

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
Metal halides
Discrete Fourier transforms
Electronic structure
Energy gap
Electronic properties
4 Citations (Scopus)

Charge transport in nanoscale vertical organic semiconductor pillar devices

Wilbers, J. G. E., Xu, B., Bobbert, P. A., de Jong, M. P. & van der Wiel, W. G., 24 Jan 2017, In : Scientific Reports. 7, 9 p., 41171

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
organic semiconductors
semiconductor devices
high current
current density
transistors
7 Citations (Scopus)

Effect of Coulomb correlation on charge transport in disordered organic semiconductors

Liu, F., van Eersel, H., Xu, B., Wilbers, J. G. E., De Jong, M. P., van der Wiel, W. G., Bobbert, P. A. & Coehoorn, R., 20 Nov 2017, In : Physical Review B. 96, 20, 8 p., 205203

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
Semiconducting organic compounds
organic semiconductors
Charge carriers
Carrier concentration
Charge transfer
10 Citations (Scopus)

Effect of polaron diffusion on exciton-polaron quenching in disordered organic semiconductors

Coehoorn, R., Zhang, L., Bobbert, P. A. & van Eersel, H., 6 Apr 2017, In : Physical Review B. 95, 13, 12 p., 134202

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
Gene Conversion
Semiconducting organic compounds
organic semiconductors
Excitons
Quenching
15 Citations (Scopus)

Effects of energy correlations and superexchange on charge transport and exciton formation in amorphous molecular semiconductors: an ab initio study

Massé, A., Friederich, P., Symalla, F., Liu, F., Meded, V., Coehoorn, R., Wenzel, W. & Bobbert, P. A., 31 Mar 2017, In : Physical Review B. 95, 11, p. 1-11 115204

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
Excitons
Charge transfer
excitons
Semiconductor materials
Hole mobility
3 Citations (Scopus)

Fabrication, electrical characterization and device simulation of vertical P3HT field-effect transistors

Xu, B., Dogan, T., Wilbers, J. G. E., de Jong, M. P., Bobbert, P. A. & van der Wiel, W. G., 1 Dec 2017, In : Journal of Science: Advanced Materials and Devices. 2, 4, p. 501-514 14 p.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
Organic field effect transistors
Field effect transistors
Fabrication
Electrodes
Gate dielectrics
2 Citations (Scopus)

Förster-type triplet-polaron quenching in disordered organic semiconductors

Coehoorn, R., Bobbert, P. A. & Van Eersel, H., 15 Nov 2017, In : Physical Review B. 96, 18, 11 p., 184203

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
Gene Conversion
Semiconducting organic compounds
organic semiconductors
Quenching
quenching
10 Citations (Scopus)

Modeling carrier density dependent charge transport in semiconducting carbon nanotube networks

Schiessl, S. P., de Vries, X., Rother, M., Masse, A., Brohmann, M., Bobbert, P. A. & Zaumseil, J., 27 Sep 2017, In : Physical Review Materials. 1, 4, 13 p., 046003

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File

Multiscale modeling of charge transport in organic devices : from molecule to device

Massé, A., 12 Jan 2017, Eindhoven: Technische Universiteit Eindhoven. 103 p.

Research output: ThesisPhd Thesis 1 (Research TU/e / Graduation TU/e)Academic

Open Access
File
2 Citations (Scopus)

Organic light-emitting diodes

Kordt, P., Bobbert, P., Coehoorn, R., May, F., Lennartz, C. & Andrienko, D., 1 Jan 2017, Handbook of Optoelectronic Device Modeling and Simulation: Fundamentals, Materials, Nanostructures, LEDs, and Amplifiers. Ohio: CRC Press, p. 473-522 50 p. (Series in Optics and Optoelectronics; vol. 1)

Research output: Chapter in Book/Report/Conference proceedingChapterAcademicpeer-review

Organic light emitting diodes (OLED)
Light emitting diodes
light emitting diodes
Display devices
Liquid crystal displays

Theory of hyperfine field-induced organic magnetic field effects

Kersten, S., Koopmans, B. & Bobbert, P., 27 Dec 2017, World Scientific Reference on Spin in Organics: Volume 3: Magnetic Field Effects. World Scientific, p. 39-90 52 p.

Research output: Chapter in Book/Report/Conference proceedingChapterAcademicpeer-review

Magnetic field effects
Polarons
polarons
Semiconducting organic compounds
Excitons
2016
24 Citations (Scopus)

Ab initio charge-carrier mobility model for amorphous molecular semiconductors

Massé, A., Friederich, P., Symalla, F., Liu, F., Nitsche, R., Coehoorn, R., Wenzel, W. & Bobbert, P. A., 19 May 2016, In : Physical Review B. 93, 19, 9 p., 195209

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
Carrier mobility
carrier mobility
Charge carriers
charge carriers
Semiconductor materials
6 Citations (Scopus)

Ab initio modeling of steady-state and time-dependent charge transport in hole-only α-NPD devices

Liu, F., Massé, A., Friedrich, P., Symalla, F., Nitsche, R., Wenzel, W., Coehoorn, R. & Bobbert, P. A., Dec 2016, In : Applied Physics Letters. 109, 24, p. 1-4 2433301

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
diamines
electric potential
boxes
simulation
impedance
8 Citations (Scopus)

Analysis of the phosphorescent dye concentration dependence of triplet-triplet annihilation in organic host-guest systems

Zhang, L., van Eersel, H., Bobbert, P. A. & Coehoorn, R., 1 Oct 2016, In : Chemical Physics Letters. 662, p. 221–227

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
Photoluminescence
Coloring Agents
dyes
photoluminescence
Energy transfer
14 Citations (Scopus)

Charge transport by superexchange in molecular host-guest systems

Symalla, F., Friedrich, P., Massé, A., Meded, V., Coehoorn, R., Bobbert, P. A. & Wenzel, W., 29 Dec 2016, In : Physical Review Letters. 117, 27, 6 p., 276803

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
emitters
organic semiconductors
low concentrations
light emitting diodes
traps
11 Citations (Scopus)
Open Access
File
Coloring Agents
dyes
Iridium
Organic light emitting diodes (OLED)
iridium
14 Citations (Scopus)
Open Access
File
light emitting diodes
quenching
dyes
matrix materials
kinetics

Effects of charge-exciton and exciton-exciton interactions on the efficiency of oleds : experimental and advanced modelling studies

Coehoorn, R., Zhang, L., van Eersel, H. & Bobbert, P. A., 2016, Solid-State Lighting, SSL 2016. Washington, D.C.: Optical Society of America (OSA), 1 p. SSM4C.3

Research output: Chapter in Book/Report/Conference proceedingConference contributionAcademicpeer-review

Excitons
Organic light emitting diodes (OLED)
Luminance
LDS 751
Experiments
8 Citations (Scopus)

Kinetic Monte Carlo modeling of the efficiency roll-off in a multilayer white organic light-emitting device

Mesta, M., van Eersel, H., Coehoorn, R. & Bobbert, P. A., 1 Mar 2016, In : Applied Physics Letters. 108, 13, 5 p., 133301

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
quenching
kinetics
quantum efficiency
radii
emitters
6 Citations (Scopus)

Molecular dynamics simulation of poly(3-hexylthiophene) helical structure in vacuo and in amorphous polymer surrounding

Borzdun, N. I., Larin, S. V., Falkovich, S. G., Nazarychev, V. M., Volgin, I., Yakimansky, A. V., Lyulin, A., Negi, V., Bobbert, P. A. & Lyulin, S. V., 1 Dec 2016, In : Journal of Polymer Science, Part B: Polymer Physics. 54, 23, p. 2448-2456 9 p.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
3 Citations (Scopus)

Solvent-dependent structure formation in drying P3HT : PCBM films studied by molecular dynamics simulations

Negi, V., Lyulin, A. & Bobbert, P. A., Nov 2016, In : Macromolecular Theory and Simulations. 25, 6, p. 550-558

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
2015

Device physics of organic light-emitting diodes : interplay between charges and excitons

Eersel, van, H., 16 Nov 2015, Eindhoven: Technische Universiteit Eindhoven. 232 p.

Research output: ThesisPhd Thesis 1 (Research TU/e / Graduation TU/e)Academic

Open Access
File
Open Access
File
51 Citations (Scopus)

Kinetic Monte Carlo study of sensitiviy of OLED efficiency and lifetime to materials parameters

Coehoorn, R., Eersel, van, H., Bobbert, P. A. & Janssen, R. A. J., 2015, In : Advanced Functional Materials. 25, 13, p. 2024-2037

Research output: Contribution to journalArticleAcademicpeer-review

Gene Conversion
Organic light emitting diodes (OLED)
Quenching
light emitting diodes
Excitons
18 Citations (Scopus)

Kinetic Monte Carlo study of triplet-triplet annihilation in organic phosphorescent emitters

Eersel, van, H., Bobbert, P. A. & Coehoorn, R., 2015, In : Journal of Applied Physics. 117, p. 115502-1/11 12 p.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
emitters
kinetics
photoluminescence
interactions
organic materials
Open Access
File

Retraction

Mahato, R. N., Lülf, H., Siekman, M. H., Kersten, S. P., Bobbert, P. A., de Jong, M. P., De Cola, L. & van der Wiel, W. G., 9 Oct 2015, In : Science. 350, 6257, p. 170-170 1 p.

Research output: Contribution to journalLetterAcademicpeer-review

Open Access
molecular chains
magnetic fields
organic semiconductors
room temperature
wire
8 Citations (Scopus)

ΔB mechanism for fringe-field organic magnetoresistance

Cox, M., Kersten, S., Veerhoek, M., Bobbert, P. & Koopmans, B., 23 Apr 2015, In : Physical Review B. 91, 16, 7 p., 165205

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
2014
8 Citations (Scopus)

Intrinsic magnetic field effects in organic semiconductors

Wohlgenannt, M., Bobbert, P. A. & Koopmans, B., 2014, In : MRS Bulletin. 39, 7, p. 590-596

Research output: Contribution to journalArticleAcademicpeer-review

Magnetic field effects
Semiconducting organic compounds
organic semiconductors
Magnetoresistance
Magnetoelectronics
5 Citations (Scopus)

Manipulating spin in organic spintronics : probing the interplay between the electronic and nuclear spins in organic semiconductors

Bobbert, P. A., 2014, In : Science. 345, 6203, p. 1450-1451 2 p.

Research output: Contribution to journalArticleAcademicpeer-review

organic semiconductors
nuclear spin
manipulators
electronics
germanium
41 Citations (Scopus)
Open Access
File
light emitting diodes
quenching
dyes
current density
iridium