Center for Computational Energy Research Science for Energy

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2019

Efficient intraband hot carrier relaxation in Sn and Pb perovskite semiconductors mediated by strong electron-phonon coupling

Monti, M., Woolley, J. M., Staniforth, M., Wijesekara, A., Tao, S. X., Bandara, R. M. I., Jayawardena, I., Crocker, A., Griffin, E., Silva, S. R. P., Hatton, R. A. & Lloyd-Hughes, J., 27 feb 2019, Ultrafast Phenomena and Nanophotonics XXIII. Betz, M. & Elezzabi, A. Y. (redactie). SPIE, 8 blz. 109160M. (Proceedings of SPIE; vol. 10916).

Onderzoeksoutput: Hoofdstuk in Boek/Rapport/CongresprocedureConferentiebijdrageAcademicpeer review

Perovskite
Hot carriers
Phonon
Photoconductivity
Semiconductors
2018
60 Downloads (Pure)

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). blz. 1-9

Onderzoeksoutput: Hoofdstuk in Boek/Rapport/CongresprocedureConferentiebijdrageAcademic

Open Access
Bestand

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).

Onderzoeksoutput: Hoofdstuk in Boek/Rapport/CongresprocedureConferentiebijdrageAcademic

Alkalies
Cations
Ions
Monovalent Cations
Density functional theory

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.

Onderzoeksoutput: Hoofdstuk in Boek/Rapport/CongresprocedureConferentiebijdrageAcademic

Ion exchange
Anions
Cations
Substitution reactions
Solar absorbers

Probing the occupied and unoccupied density of states of hybrid Perovskites

Olthof, S., Schmidt, I., Tao, S. X. & Meerholz, K., 2018, MRS Spring Meeting & Exhibit: Symposia EN15 : Novel Materials of Perovskite Semiconductors . EN 15.06.07

Onderzoeksoutput: Hoofdstuk in Boek/Rapport/CongresprocedureConferentiebijdrageAcademic

Electron affinity
Halogens
Tin
Ionization potential
Photoelectron spectroscopy

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).

Onderzoeksoutput: Hoofdstuk in Boek/Rapport/CongresprocedureConferentiebijdrageAcademic

Tin
Ion exchange
Solar cells
Substitution reactions
Air
2017
40 Downloads (Pure)

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. blz. 1-9

Onderzoeksoutput: Hoofdstuk in Boek/Rapport/CongresprocedureConferentiebijdrageAcademic

Open Access
Bestand
12 Downloads (Pure)

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. blz. 1-9

Onderzoeksoutput: Hoofdstuk in Boek/Rapport/CongresprocedureConferentiebijdrageAcademic

Open Access
Bestand
14 Downloads (Pure)

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. blz. 1-9

Onderzoeksoutput: Hoofdstuk in Boek/Rapport/CongresprocedureConferentiebijdrageAcademic

Open Access
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The application of the DFT-1/2 method for accurate band gap prediction of group III/V and hybrid perovskites semiconductors

Tao, S. X., 2017, Multiscale Solar Workshop, 7th-9th April, 2017, Belgrade, Serbia.

Onderzoeksoutput: Hoofdstuk in Boek/Rapport/CongresprocedureConferentiebijdrageAcademic

Towards high-efficiency multi-junction nanowire solar cells : a combination of DFT and Monte Carlo modeling

Tao, S. X., 2017, Photovoltaic Technology Conference (PVTC) 2017, 26-28 April 2017, Marseille, France.

Onderzoeksoutput: Hoofdstuk in Boek/Rapport/CongresprocedureConferentiebijdrageAcademic