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Research Output

  • 673 Citations
  • 35 Article
  • 13 Conference contribution
  • 1 Phd Thesis 1 (Research TU/e / Graduation TU/e)
2020

Near-Infrared emission from tin–Lead (Sn–Pb) alloyed perovskite quantum dots by sodium doping

Liu, F., Jiang, J., Zhang, Y., Ding, C., Toyoda, T., Hayase, S., Wang, R., Tao, S. & Shen, Q., 1 Jan 2020, (Accepted/In press) In : Angewandte Chemie - International Edition.

Research output: Contribution to journalArticleAcademicpeer-review

Stabilizing Perovskite Light-Emitting Diodes by incorporation of binary alkali cations

Li, N., Song, L., Jia, Y., Dong, Y., Xie, F., Wang, L., Tao, S. & Zhao, N., 1 Jan 2020, (Accepted/In press) In : Advanced Materials. p. e1907786

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
2019

Absolute energy level positions in tin- and lead-based halide perovskites

Tao, S., Schmidt, I., Brocks, G., Jiang, J., Tranca, I., Meerholz, K. & Olthof, S., 12 Jun 2019, In : Nature Communications. 10, 1, 10 p., 2560.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
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12 Citations (Scopus)
42 Downloads (Pure)

Cation and anion immobilization through chemical bonding enhancement with fluorides for stable halide perovskite solar cells

Li, N., Tao, S., Chen, Y., Niu, X., Onwudinanti, C. K., Hu, C., Qiu, Z., Xu, Z., Zheng, G., Wang, L., Li, L., Liu, H., Lun, Y., Hong, J., Wang, X., Liu, Y., Xie, H., Gao, Y., Bai, Y., Yang, S. & 3 others, Brocks, G., Chen, Q. & Zhou, H., 1 May 2019, In : Nature Energy. 4, 5, p. 408-415 8 p.

Research output: Contribution to journalArticleAcademicpeer-review

64 Citations (Scopus)
1 Downloads (Pure)

CsPb(IxBr1− x)3 solar cells

Jia, X., Zuo, C., Tao, S., Sun, K., Zhao, Y., Yang, S., Cheng, M., Wang, M., Yuan, Y., Yang, J., Gao, F., Xing, G., Wei, Z., Zhang, L., Yip, H. L., Liu, M., Shen, Q., Yin, L., Han, L., Liu, S. & 5 others, Wang, L., Luo, J., Tan, H., Jin, Z. & Ding, L., 1 Oct 2019, In : Science Bulletin. 64, 20, p. 1532-1539 8 p.

Research output: Contribution to journalArticleAcademicpeer-review

12 Citations (Scopus)

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. (eds.). SPIE, 8 p. 109160M. (Proceedings of SPIE; vol. 10916).

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

Enhanced incorporation of guanidinium in formamidinium-based perovskites for efficient and stable photovoltaics: the role of Cs and Br

Zhou, Y., Xue, H., Jia, Y. H., Brocks, G., Tao, S. & Zhao, N., 1 Nov 2019, In : Advanced Functional Materials. 29, 48, 9 p., 1905739.

Research output: Contribution to journalArticleAcademicpeer-review

1 Citation (Scopus)

GeI 2 additive for high optoelectronic quality CsPbI 3 quantum dots and their application in photovoltaic devices

Liu, F., Ding, C., Zhang, Y., Kamisaka, T., Zhao, Q., Luther, J. M., Toyoda, T., Hayase, S., Minemoto, T., Yoshino, K., Zhang, B., Dai, S., Jiang, J., Tao, S. & Shen, Q., 12 Feb 2019, In : Chemistry of Materials. 31, 3, p. 798-807 10 p.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
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21 Citations (Scopus)
1 Downloads (Pure)

The importance of charge redistribution during electrochemical reactions: a density functional theory study of silver orthophosphate (Ag 3 PO 4)

Cao, X., Zhang, X., Sinha, R., Tao, S. & Bieberle-Hütter, A., 8 May 2019, In : Physical Chemistry Chemical Physics. 21, 18, p. 9531-9537 7 p.

Research output: Contribution to journalArticleAcademicpeer-review

1 Citation (Scopus)

Tin, the enabler—hydrogen diffusion into ruthenium

Onwudinanti, C., Tranca, I., Morgan, T. & Tao, S., 21 Jan 2019, In : Nanomaterials. 9, 1, 18 p., 129.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
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3 Citations (Scopus)
24 Downloads (Pure)
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
64 Downloads (Pure)

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

Cs 1-: X Rb x SnI 3 light harvesting semiconductors for perovskite photovoltaics

Marshall, K. P., Tao, S., Walker, M., Cook, D. S., Lloyd-Hughes, J., Varagnolo, S., Wijesekara, A., Walker, D., Walton, R. I. & Hatton, R. A., 1 Aug 2018, In : Materials Chemistry Frontiers. 2, 8, p. 1515-1522 8 p.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
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14 Citations (Scopus)
63 Downloads (Pure)

Efficient intraband hot carrier relaxation in the Perovskite semiconductor Cs1- xRbxSnI3 mediated by strong electron-phonon coupling

Monti, M., Tao, S. X., Staniforth, M., Crocker, A., Griffin, E., Wijesekara, A., Hatton, R. A. & Lloyd-Hughes, J., 13 Sep 2018, In : Journal of Physical Chemistry C. 122, 36, p. 20669-20675 7 p.

Research output: Contribution to journalArticleAcademicpeer-review

6 Citations (Scopus)

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

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., 27 Jun 2018, In : Advanced Materials. 30, 26, 9 p., 1707350.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
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34 Citations (Scopus)
47 Downloads (Pure)

Multiscale in modelling and validation for solar photovoltaics

Multisolar COST action, 23 Oct 2018, In : EPJ Photovoltaics. 9, 16 p., 10.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
2 Citations (Scopus)
17 Downloads (Pure)

Partially replacing Pb2+ by Mn2+ in hybrid metal halide perovskites: Structural and electronic properties

Bartesaghi, D., Ray, A., Jiang, J., Bouwer, R. K. M., Tao, S. & Savenije, T. J., 1 Dec 2018, In : APL Materials. 6, 12, 12 p., 121106.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
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1 Citation (Scopus)
33 Downloads (Pure)

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

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

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

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

Jiang, J., Onwudinanti, C., Hatton, R. A., Bobbert, P. A. & Tao, S., 9 Aug 2018, In : Journal of Physical Chemistry C. 122, 31, p. 17660-17667 8 p.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
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11 Citations (Scopus)
304 Downloads (Pure)

Unravelling light-induced degradation of layered perovskite crystals and design of efficient encapsulation for improved photostability

Fang, H. H., Yang, J., Tao, S. X., Adjokatse, S., Kamminga, M., Ye, J., Blake, G., Even, J. & Loi, M., 24 May 2018, In : Advanced Functional Materials. 28, 21, 11 p., 1800305.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
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22 Citations (Scopus)
64 Downloads (Pure)
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, 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
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, Computational Sciences for Future Energy Conference 2017. p. 1-9

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

Open Access
File
42 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. p. 1-9

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

Open Access
File
14 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., 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
41 Citations (Scopus)
172 Downloads (Pure)

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.

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

The Tynode: a new vacuum electron multiplier

van der Graaf, H., Akhtar, H., Budko, N., Chan, H. W., Hagen, C. W., Hansson, C. C. T., Nützel, G., Pinto, S. D., Prodanović, V., Raftari, B., Sarro, P. M., Sinsheimer, J., Smedley, J., Tao, S. X., Theulings, A. M. M. G. & Vuik, K., 1 Mar 2017, In : Nuclear Instruments and Methods in Physics Research. Section A: Accelerators, Spectrometers, Detectors and Associated Equipment. 847, p. 148-161 14 p.

Research output: Contribution to journalArticleAcademicpeer-review

4 Citations (Scopus)
2 Downloads (Pure)

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.

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

2016

Potential applications of electron emission membranes in medicine

Bilevych, Y., Brunner, S. E., Chan, H. W., Tao, S. X. & van der Graaf, H., 2016, In : Nuclear Instruments and Methods in Physics Research. Section A: Accelerators, Spectrometers, Detectors and Associated Equipment. 809, 11, p. 171-174

Research output: Contribution to journalArticleAcademicpeer-review

5 Citations (Scopus)
1 Downloads (Pure)

Secondary electron emission materials for transmission dynodes in novel photomultipliers : a review

Tao, S. X., Chan, H. W. & van der Graaf, H., 2016, In : Materials. 9, 12, 18 p., 1017.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
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18 Citations (Scopus)
100 Downloads (Pure)
2015

DFT study of electron affinity of alkali metal termination on clean and oxygenated β-Si3N4

Tao, S. X., Theulings, A. M. M. G., Smedley, J. & van der Graaf, H., 1 Sep 2015, In : Diamond and Related Materials. 58, September 2015, p. 214-220 7 p.

Research output: Contribution to journalArticleAcademicpeer-review

4 Citations (Scopus)

DFT study of electron affinity of hydrogen terminated β-Si3N4

Tao, S. X., Theulings, A. M. M. G., Smedley, J. & van der Graaf, H., 2015, In : Diamond and Related Materials. 53, p. 52-57

Research output: Contribution to journalArticleAcademicpeer-review

12 Citations (Scopus)

Optical properties of silicon-rich silicon nitride (SixNyHz) from first principles

Tao, S. X., Theulings, A. M. M. G., Prodanović, V., Smedley, J. & van der Graaf, H., 2015, In : Computation. 3, p. 657-669 13 p.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
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6 Citations (Scopus)
15 Downloads (Pure)

Optimization of silicon-rich silicon nitride films for electron multiplication in timed photon counters

Prodanovic, V., Chan, H. W., Smedley, J., Theulings, A., Tao, S. X., van der Graaf, H. & Sarro, P. M., 2015, In : Procedia Engineering. 120, p. 1111-1114

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
2 Citations (Scopus)
35 Downloads (Pure)
2014

Electron emission processes in photocathodes and dynodes

Smedley, J., Schubert, S. G., Xie, J., Ruiz-Osës, M., Liang, X., Muller, E. M., Padmore, H. A., Wong, J., Hulbert, S., Theulings, A. M. M. G., Tao, S. X. & van der Graaf, H., 2014, 2014 IEEE Nuclear Science Symposium and Medical Imaging Conference (NSS/MIC), 8-15 November 2014, Seattle, Washington. Piscataway: Institute of Electrical and Electronics Engineers, p. 1-4 4 p.

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

1 Citation (Scopus)
2012

TEM guided microstructural design of MgH 2 powders and thin film alloys with room temperature volumetric hydrogen cycling ability

Mitlin, D., Kalisvaart, P., Danaie, M., Tao, S. X., Zahiri, B. & Fritzsche, H., 2012, AIP Conference Proceedings, Berlin, Germany.

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

2011

Dehydrogenation properties of epitaxial (100) MgH2/TiH2 multi-layers : a DFT study

Tao, S., Notten, P. H. L., Santen, van, R. A. & Jansen, A. P. J., 2011, In : Computational Materials Science. 50, 10, p. 2960-2966 7 p.

Research output: Contribution to journalArticleAcademicpeer-review

9 Citations (Scopus)

DFT studies of hydrogen storage properties of Mg0.75Ti0.25

Tao, S., Notten, P. H. L., Santen, van, R. A. & Jansen, A. P. J., 2011, In : Journal of Alloys and Compounds. 509, 2, p. 210-216 17 p.

Research output: Contribution to journalArticleAcademicpeer-review

14 Citations (Scopus)

First-principles predictions of potential hydrogen storage materials : nanosized Ti(core)/Mg(shell) hydrides

Tao, S., Notten, P. H. L., Santen, van, R. A. & Jansen, A. P. J., 2011, In : Physical Review B. 83, p. 195403-1/8 8 p., 195403.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
19 Citations (Scopus)
92 Downloads (Pure)

First principle study of hydrogen diffusion in equilibrium rutile, rutile with deformation twins and fluorite polymorph of Mg hydride

Tao, S. X., Kalisvaart, W. P., Danaie, M., Midlin, D., Notten, P. H. L., Santen, van, R. A. & Jansen, A. P. J., 2011, In : International Journal of Hydrogen Energy. 36, 18, p. 11802-11809 8 p.

Research output: Contribution to journalArticleAcademicpeer-review

27 Citations (Scopus)

Hydrogen storage in Mg transition metal alloys : a DFT study

Tao, S., 2011, Eindhoven: Technische Universiteit Eindhoven. 136 p.

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

Open Access
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1787 Downloads (Pure)
2010

Analysis of deformation twins and the partially dehydrogenated microstructure in nanocrystalline magnesium hydride (MgH2) powder

Danaie, M., Tao, S. X., Mitlin, D. & Kalisvaart, W. P., 2010, In : Acta Materialia. 58, p. 3162-3172

Research output: Contribution to journalArticleAcademicpeer-review

50 Citations (Scopus)

First-principles analysis of the C-N bond scission of methylamine on Mo-based model catalysts

Lv, C. Q., Li, J., Tao, S. X., Ling, K. C. & Wang, G. C., 2010, In : Journal of Chemical Physics. 132, 4, 044111.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
12 Citations (Scopus)
61 Downloads (Pure)

Fluorite transition metal hydride induced destabilization of the MgH2 system in MgH2/TMH2 multilayers (TM=Sc, Ti, V, Cr, Y, Zr, Nb, La, Hf)

Tao, S-X., Notten, P. H. L., Santen, van, R. A. & Jansen, A. P. J., 2010, In : Physical Review B. 82, 12, p. 125448-1/5 5 p., 125448.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
31 Citations (Scopus)
60 Downloads (Pure)
2009

Density functional theory studies of the hydrogenation properties of Mg and Ti

Tao, S., Notten, P. H. L., Santen, van, R. A. & Jansen, A. P. J., 2009, In : Physical Review B. 79, 14, p. 144121-1/7 7 p., 144121.

Research output: Contribution to journalArticleAcademicpeer-review

Open Access
File
24 Citations (Scopus)
90 Downloads (Pure)
2008

Cubic MgH2 stabilized by alloying with transition metals : a density functional theory study

Pauw, B. R., Kalisvaart, W. P., Tao, S. X., Koper, M. T. M., Jansen, A. P. J. & Notten, P. H. L., 2008, In : Acta Materialia. 56, 13, p. 2948-2954

Research output: Contribution to journalArticleAcademicpeer-review

34 Citations (Scopus)
2006

A systematic theoretical study of water dissociation on clean and oxygen-preadsorbed transition metals

Wang, G. C., Tao, S. X. & Bu, X. H., 2006, In : Journal of Catalysis. 244, p. 10-16

Research output: Contribution to journalArticleAcademicpeer-review

134 Citations (Scopus)

Effect of pre-covered oxygen on the dehydrogenation reactions over copper surface : A DFT Study

Tao, S. X., Wang, G. C. & Bu, X. H., 2006, In : Journal of Physical Chemistry B. 110, 26045.

Research output: Contribution to journalArticleAcademicpeer-review

22 Citations (Scopus)