Publications

Published during second funding period of the project (2023-2025)

25
A. S. Mirza, B. Vishal, P. Dally, C. S. Schnohr, S. De Wolf, M. Morales-Masis
Cs-Doped and Cs-S Co-Doped CuI p-Type Transparent Semiconductors with Enhanced Conductivity
Adv. Funct. Mater. 2024, 2316144
doi

24
C. Dethloff, K. Thieme, S. Selle, M. Seifert, S. Vogt, D. Splith, S. Botti, M. Grundmann, M. Lorenz
Ni-Alloyed Copper Iodide Thin Films: Microstructural Features and Functional Performance
Phys. Status Solidi B XXX(XX), 2300492:1-11 (2024)
doi

23
A. Müller, S. Henn, E. Krüger, S. Blaurock, H. Krautscheid, M. Grundmann, C. Sturm
Two- and three-photon absorption in bulk CuI
Appl. Phys. Lett. 123, 122103 (2023)
doi

22
M. Lorenz, P. Storm, S. Gierth, S. Selle, H. von Wenckstern, M. Grundmann
Diffundierter Sauerstoff als dominierender flacher Akzeptor in p-Typ Kupferiodid-Dünnfilmen
Chemie Ingenieur Technik 95(11), online:1-9 (2023)
doi

21
R. Hildebrandt, M. Seifert, J. George, S. Blaurock, S. Botti, H. Krautscheid, M. Grundmann, C. Sturm
Temperature dependent second-order Raman scattering in CuI
arxiv: 2305.18931 (2023)
doi

20
F. Geng, L. Wang, T. Stralka, D. Splith, S. Ruan, J. Yang, L. Yang, G. Gao, L. Xu, M. Lorenz, M. Grundmann, J. Zhu, C. Yang
(111)-oriented growth and acceptor doping of transparent conductive CuI:S thin films
by spin coating and RF-sputtering
Adv. Engin. Mater. 25(11), 2201666:1-5 (2023)
doi

19
E. Krüger, M. Seifert, V. Gottschalch, H. Krautscheid, C. S. Schnohr, S. Botti, M. Grundmann, C. Sturm
Optical properties of Ag_xCu_1–xI alloy thin films
AIP Adv. 13(3), 035117:1-11 (2023)
doi

18
T. Stralka, M. Bar, F. Schöppach, S. Selle, C. Yang, H. von Wenckstern, M. Grundmann
Grain and grain boundary conduction channels in copper iodide thin films
Phys. Status Solidi A 220(6), 2200883:1-8 (2023)
doi

17
E. M. Zollner, S. Selle, C. Yang, K. Ritter, S. Eckner, E. Welter, M. Grundmann, C. S. Schnohr
Oxygen-induced phase separation in sputtered Cu-Sn-I-O thin films
Phys. Status Solidi A, 220(5), 2200646:1-10 (2023)
doi

Published during first funding period of the project (2019-2022)

16
E. Krüger, V. Gottschalch, C. Yang, R. Hildebrandt, A. L. Pereira, M. S. Bar, S. Blaurock, S. Merker, C. Sturm, M. Grundmann,
H. Krautscheid
Epitaxial growth of Ag_xCu_1-xI on Al₂O₃(0001)
Phys. Status Solidi B 260(2), 2200493:1-8 (2023)
doi

15
M. Seifert, E. Krüger, M. Bar, S. Merker, H. von Wenckstern, H. Krautscheid, M. Grundmann, C. Sturm, S. Botti
Dielectric function of CuBr_xI_1-x alloy thin films
Phys. Rev. Materials 6(12), 124601:1-11 (2022)
doi

14
P. Storm, K. Karimova, M. S. Bar, S. Selle, H. von Wenckstern, M. Grundmann, M. Lorenz
Suppression of rotational domains of CuI employing sodium halide buffer layers
ACS Appl. Mater. Interfaces 14(10), 12350-12358 (2022)
doi

13
P. Storm, S. Selle, H. von Wenckstern, M.Grundmann, M.Lorenz
Epitaxial lift-off of single crystalline CuI thin films
J. Phys. Chem. C, 10(11), 4124-4127 (2022)
doi

12
E. Krüger, M. S. Bar, S. Blaurock, L. Trefflich, R. Hildebrandt, A. Müller, O. Herrfurth, G.Benndorf, H. von Wenckstern,
H. Krautscheid, M. Grundmann, C. Sturm
Dynamics of exciton-polariton emission in CuI
APL Mater. 9(12), 121102:1-12 (2021)
doi

11
M. Seifert, M. Kawashima, C. Rödl, S. Botti
Layered CuI: a path to 2D p-type transparent conducting materials
J. Mater. Chem. C 9, 11284-11291 (2021)
doi

10
P. Storm, S. Gierth, S. Selle, M.S. Bar, H. von Wenckstern, M. Grundmann, M. Lorenz
Evidence for oxygen being a dominant shallow acceptor in p-type CuI
APL Mater. 9(5), 051101:1-9 (2021)
doi

9
V. Gottschalch, G. Benndorf, S. Selle, E. Krüger, S. Blaurock, M. Kneiß, M. Bar, C. Sturm, S. Merker, T. Höche,
M. Grundmann, H. Krautscheid
Epitaxial growth of rhombohedral β- and cubic γ-CuI
J. Cryst. Growth 570, 126218 (2021)
doi

8
O. Herrfurth, E. Krüger, S. Blaurock, H. Krautscheid, M. Grundmann
Hot-phonon effects in photo-excited wide-bandgap semiconductors
J. Phys.: Condens. Matter 33(20), 205701:1-9 (2021)
doi

7
P. Storm, M. S. Bar, S. Selle, H.von Wenckstern, M. Grundmann, M. Lorenz
P-type doping and alloying of CuI thin films with selenium
Phys. Status Solidi RRL 15(8), 202100214:1-5 (2021)
doi

6
J. Shi, E. Fonda, S. Botti, M.A.L. Marques, T. Shinmei, T. Irifune, ... & A. San-Miguel
Halogen molecular modifications at high pressure: the case of iodine
Phys. Chem. Chem. Phys. 23(5), 3321-3326 (2021)
doi

5
W. Yu, G. Benndorf, Y. Jiang, K. Jiang, C. Yang, M. Lorenz, M. Grundmann
Control of optical absorption and emission of sputtered copper iodide thin films
Phys. Status Solidi RRL 15(1), 2000431:1-5 (2021)
doi

4
P. Storm, M. Bar, S. Selle, C. Yang, H. von Wenckstern, M. Grundmann, M. Lorenz
High mobility, highly transparent, smooth, p-type CuI thin films grown by pulsed laser deposition
APL Mater. 8(9), 091115:1-8 (2020)
doi

3
C. Yang, E. Rose, W. Yu, T. Stralka, F. Geng, M. Lorenz, M. Grundmann
Controllable growth of copper iodide by sputtering towards high-mobility thin films and self-assembled microcrystals
ACS Applied Electronic Materials 2(11), 3627-3632 (2020)
doi

2
P. Borlido, J. Schmidt, A.W. Huran, F. Tran, M.A.L. Marques, S. Botti
Exchange-correlation functionals for band gaps of solids: Benchmark, reparametrization and machine learning
NPJ Comput. Mater. 6, 96 (2020)
doi

1
P. Borlido, J. Doumont, F. Tran, M.A.L. Marques, S. Botti
Validation of pseudopotential calculations for the electronic band gap of solids
J. Chem. Theor. Comput. 16, 3620-3627 (2020)
doi

Published before the start of the project

13
M. Graužinyte, S. Botti, M.A.L. Marques, S. Goedecker, and J.A. Flores-Livas
Computational acceleration of prospective dopant discovery in cuprous iodide
Phys. Chem. Chem. Phys. (inside front cover, selected as a 2019 HOT PCCP Article) 21, 18839-18849 (2019)
doi

12
S. Jaschik, M.R.G. Marques, M. Seifert, C. Rödl, S. Botti, and M.A.L. Marques
Stable Ordered Phases of Cuprous Iodide with Complexes of Copper Vacancies
Chem. Mater. 31, 7877-7882 (2019)
doi

11
M. Kneiß, C. Yang, J. Barzola-Quiquia, G. Benndorf, H. von Wenckstern, P. Esquinazi, M. Lorenz, M. Grundmann
Suppression of grain boundary scattering in p-type transparent γ-CuI thin films due to interface tunneling currents
Adv. Mater. Interf. 5(6), 1701411:1-12 (2018)
doi

10
M. Wille, E. Krüger, S. Blaurock, V. Zviagin, R. Deichsel, G. Benndorf, L. Trefflich, V. Gottschalch, H. Krautscheid, R. Schmidt-Grund, M. Grundmann
Lasing in cuprous iodide microwires
Appl. Phys. Lett. 111(3), 031105:1-5 (2017)
doi

9
V. Gottschalch, S. Blaurock, G. Benndorf, J. Lenzner, M. Grundmann, H. Krautscheid
Copper Iodide synthesized by iodization of Cu-films and deposited using MOCVD
J. Cryst. Growth 471, 21-28 (2017)
doi

8
C. Yang, D. Souchay, M. Kneiß, M. Bogner, H. M. Wei, M. Lorenz, O. Oeckler, G. Benstetter, Y.Q. Fu, M. Grundmann
Transparent Flexible Thermoelectric Material Based on Non-toxic Earth-Abundant p-Type Copper Iodide Thin Film
Nature Commun. 8, 16076:1-7 (2017)
doi

7
M. Grundmann, F. Klüpfel, R. Karsthof, P. Schlupp, F.-L. Schein, D. Splith, C. Yang, S. Bitter, H. von Wenckstern
Oxide Bipolar Electronics: Materials, Devices and Circuits
J. Phys. D: Appl. Phys. 49(21), 213001:1-25 (2016) [Topical Review]
doi

6
C. Yang, M. Kneiß, M. Lorenz, M. Grundmann
Room-temperature Synthesized Copper Iodide Thin Film as Degenerate p-Type Transparent Conducting Material with a Boosted Figure of Merit
PNAS 113(46), 12929-12933 (2016)
doi

5
C. Yang, M. Kneiß, F.-L. Schein, M. Lorenz, M. Grundmann
Room-temperature domain-epitaxy of copper iodide thin films for transparent CuI/ZnO heterojunctions with high rectification ratios larger than 10⁹
Sci. Rep. 6, 21937:1-8 (2016)
doi

4
M. Grundmann
Karl Bädeker (1877-1914) and the discovery of transparent conductive materials
Phys. Status Solidi A 212(7), 1409-1426 (2015)
doi

3
M. Grundmann, R. Karsthof, H. von Wenckstern
Interface Recombination Current in Type II Heterostructure Bipolar Diodes
ACS Appl. Mater. Interfaces 6(17), 14785-14789 (2014)
doi

2
F.-L. Schein, H. von Wenckstern, M. Grundmann
Transparent p-CuI/n-ZnO heterojunction diodes
Appl. Phys. Lett. 102(9), 092109:1-4 (2013)
doi

1
M. Grundmann, F.-L. Schein, M. Lorenz, T. Böntgen, J. Lenzner, H. von Wenckstern
Cuprous Iodide - a p-type transparent semiconductor: history and novel applications
Phys. Status Solidi A 210(9), 1671-1703 (2013)
doi