Hole-Trapping-Induced Stabilization of Ni4+ in SrNiO3/LaFeO3 Superlattices

Wang, Le; Yang, Zhenzhong; Bowden, Mark E.; Freeland, John W.; Sushko, Petr V.; Spurgeon, Steven R.; Matthews, Bethany E.; Samarakoon, Widitha S.; Zhou, Hua; Feng, Zhenxing; Engelhard, Mark H.; Du, Yingge; Chambers, Scott A.

doi:10.1002/adma.202005003

Title: Hole-Trapping-Induced Stabilization of Ni⁴⁺ in SrNiO₃/LaFeO₃ Superlattices

Journal Article · Fri Oct 02 00:00:00 EDT 2020 · Advanced Materials

DOI:https://doi.org/10.1002/adma.202005003· OSTI ID:1763017

^[1]; Yang, Zhenzhong ^[1]; Bowden, Mark E. ^[1]; Freeland, John W. ^[2];

^[1];

^[1]; Matthews, Bethany E. ^[1]; Samarakoon, Widitha S. ^[3]; Zhou, Hua ^[2]; Feng, Zhenxing ^[3];

^[1];

^[1]

Pacific Northwest National Lab. (PNNL), Richland, WA (United States)
Argonne National Lab. (ANL), Argonne, IL (United States)
Oregon State Univ., Corvallis, OR (United States)

Creating new functionality in materials containing transition metals is predicated on the ability to control the associated charge states. For a given transition metal, there is an upper limit on valence that is not exceeded under normal conditions. Here, it is demonstrated that this limit of 3+ for Ni and Fe can be exceeded via synthesis of (SrNiO3)(m)/(LaFeO3)(n)superlattices by tuningnandm. The Goldschmidt tolerance constraints are lifted, and SrNi(4+)O(3)with holes on adjacent O anions is stabilized as a perovskite at the single-unit-cell level (m = 1). Holdingm = 1, spectroscopy reveals that then = 1 superlattice contains Ni(3+)and Fe4+, whereas Ni(4+)and Fe(3+)are observed in then = 5 superlattice. It is revealed that the B-site cation valences can be tuned by controlling the magnitude of the FeO(6)octahedral rotations, which, in turn, determine the energy balance between Ni3+/Fe(4+)and Ni4+/Fe3+, thus controlling emergent electrical properties such as the band alignment and resulting hole confinement. This approach can be extended to other systems for synthesizing novel, metastable layered structures with new functionalities.

View Accepted Manuscript (DOE)

View Accepted Manuscript (Publisher)

Cite

Export

Save

Research Organization:: Pacific Northwest National Laboratory (PNNL), Richland, WA (United States); Argonne National Laboratory (ANL), Argonne, IL (United States)

Sponsoring Organization:: USDOE Office of Science (SC), Basic Energy Sciences (BES). Materials Sciences & Engineering Division; USDOE Office of Science (SC), Basic Energy Sciences (BES)

Grant/Contract Number:: AC05-76RL01830; AC02-06CH11357; 10122

OSTI ID:: 1763017

Alternate ID(s):: OSTI ID: 1779076; OSTI ID: 1804235

Report Number(s):: PNNL-SA-152538

Journal Information:: Advanced Materials, Vol. 32, Issue 45; ISSN 0935-9648

Publisher:: WileyCopyright Statement

Country of Publication:: United States

Language:: English

References (49)

Confinement-induced metal-to-insulator transition in strained LaNiO $_{3}$ /LaAlO $_{3}$ superlattices Blanca-Romero, Ariadna; Pentcheva, Rossitza Physical Review B, Vol. 84, Issue 19 https://doi.org/10.1103/PhysRevB.84.195450	journal	November 2011
Charge self-regulation upon changing the oxidation state of transition metals in insulators Raebiger, Hannes; Lany, Stephan; Zunger, Alex Nature, Vol. 453, Issue 7196 https://doi.org/10.1038/nature07009	journal	June 2008
Dimensionality Control of Electronic Phase Transitions in Nickel-Oxide Superlattices Boris, A. V.; Matiks, Y.; Benckiser, E. Science, Vol. 332, Issue 6032 https://doi.org/10.1126/science.1202647	journal	May 2011
Control of octahedral rotations in (LaNiO $_{3}$ ) $_{n}$ /(SrMnO $_{3}$ ) $_{m}$ superlattices May, S. J.; Smith, C. R.; Kim, J. -W. Physical Review B, Vol. 83, Issue 15 https://doi.org/10.1103/PhysRevB.83.153411	journal	April 2011
Turning a Nickelate Fermi Surface into a Cupratelike One through Heterostructuring Hansmann, P.; Yang, Xiaoping; Toschi, A. Physical Review Letters, Vol. 103, Issue 1 https://doi.org/10.1103/PhysRevLett.103.016401	journal	June 2009
High Pressure Synthesis of SrFe<sub>1−</sub><i><sub>x</sub></i>Ni<i><sub>x</sub></i>O<sub>3</sub> Seki, Hayato; Saito, Takashi; Shimakawa, Yuichi Journal of the Japan Society of Powder and Powder Metallurgy, Vol. 63, Issue 7 https://doi.org/10.2497/jjspm.63.609	journal	January 2016
Complete phase diagram of rare-earth nickelates from first-principles Varignon, Julien; Grisolia, Mathieu N.; Íñiguez, Jorge npj Quantum Materials, Vol. 2, Issue 1 https://doi.org/10.1038/s41535-017-0024-9	journal	April 2017
Precise Determination of the Valence-Band Edge in X-Ray Photoemission Spectra: Application to Measurement of Semiconductor Interface Potentials Kraut, E. A.; Grant, R. W.; Waldrop, J. R. Physical Review Letters, Vol. 44, Issue 24 https://doi.org/10.1103/PhysRevLett.44.1620	journal	June 1980
Orbital Order and Possible Superconductivity in ${LaNiO}_{3} / {LaMO}_{3}$ Superlattices Chaloupka, Jiří; Khaliullin, Giniyat Physical Review Letters, Vol. 100, Issue 1 https://doi.org/10.1103/PhysRevLett.100.016404	journal	January 2008
Physics of Ultrathin Films and Heterostructures of Rare-Earth Nickelates Middey, S.; Chakhalian, J.; Mahadevan, P. Annual Review of Materials Research, Vol. 46, Issue 1 https://doi.org/10.1146/annurev-matsci-070115-032057	journal	July 2016
Spin and charge ordering in self-doped Mott insulators Mizokawa, T.; Khomskii, D. I.; Sawatzky, G. A. Physical Review B, Vol. 61, Issue 17 https://doi.org/10.1103/PhysRevB.61.11263	journal	May 2000
Topotactic Phase Transition Driving Memristive Behavior Nallagatla, Venkata R.; Heisig, Thomas; Baeumer, Christoph Advanced Materials, Vol. 31, Issue 40 https://doi.org/10.1002/adma.201903391	journal	August 2019
Tuning the Electronic Structure of LaNiO ₃ through Alloying with Strontium to Enhance Oxygen Evolution Activity Liu, Jishan; Jia, Endong; Wang, Le Advanced Science, Vol. 6, Issue 19 https://doi.org/10.1002/advs.201901073	journal	August 2019
Interfacial charge-transfer Mott state in iridate–nickelate superlattices Liu, Xiaoran; Kotiuga, Michele; Kim, Heung-Sik Proceedings of the National Academy of Sciences, Vol. 116, Issue 40 https://doi.org/10.1073/pnas.1907043116	journal	September 2019
Charge transfer driven emergent phenomena in oxide heterostructures Chen, Hanghui; Millis, Andrew Journal of Physics: Condensed Matter, Vol. 29, Issue 24 https://doi.org/10.1088/1361-648X/aa6efe	journal	May 2017
Engineered Mott ground state in a LaTiO3+δ/LaNiO3 heterostructure Cao, Yanwei; Liu, Xiaoran; Kareev, M. Nature Communications, Vol. 7, Issue 1 https://doi.org/10.1038/ncomms10418	journal	January 2016
Controlled lateral anisotropy in correlated manganite heterostructures by interface-engineered oxygen octahedral coupling Liao, Z.; Huijben, M.; Zhong, Z. Nature Materials, Vol. 15, Issue 4 https://doi.org/10.1038/nmat4579	journal	March 2016
Enhanced ordering temperatures in antiferromagnetic manganite superlattices May, S. J.; Ryan, P. J.; Robertson, J. L. Nature Materials, Vol. 8, Issue 11 https://doi.org/10.1038/nmat2557	journal	October 2009
Orbital reflectometry of oxide heterostructures Benckiser, Eva; Haverkort, Maurits W.; Brück, Sebastian Nature Materials, Vol. 10, Issue 3 https://doi.org/10.1038/nmat2958	journal	February 2011
BaFeO ₃ cubic single crystalline thin film: A ferromagnetic insulator Chakraverty, S.; Matsuda, T.; Ogawa, N. Applied Physics Letters, Vol. 103, Issue 14 https://doi.org/10.1063/1.4824210	journal	September 2013
Evolution of electronic structure across the rare-earth RNiO3 series Freeland, John W.; van Veenendaal, Michel; Chakhalian, Jak Journal of Electron Spectroscopy and Related Phenomena, Vol. 208 https://doi.org/10.1016/j.elspec.2015.07.006	journal	April 2016
Hybridization-controlled charge transfer and induced magnetism at correlated oxide interfaces Grisolia, M. N.; Varignon, J.; Sanchez-Santolino, G. Nature Physics, Vol. 12, Issue 5 https://doi.org/10.1038/nphys3627	journal	January 2016
Control of octahedral connectivity in perovskite oxide heterostructures: An emerging route to multifunctional materials discovery Rondinelli, James M.; May, Steven J.; Freeland, John W. MRS Bulletin, Vol. 37, Issue 3 https://doi.org/10.1557/mrs.2012.49	journal	March 2012
Charge Transfer Across Oxide Interfaces Probed by in Situ X-ray Photoelectron and Absorption Spectroscopy Techniques Lenser, Christian; Lu, Qiyang; Crumlin, Ethan The Journal of Physical Chemistry C, Vol. 122, Issue 9 https://doi.org/10.1021/acs.jpcc.7b10284	journal	January 2018
Electronic Reconstruction at the Isopolar ${LaTiO}_{3} / {LaFeO}_{3}$ Interface: An X-Ray Photoemission and Density-Functional Theory Study Kleibeuker, J. E.; Zhong, Z.; Nishikawa, H. Physical Review Letters, Vol. 113, Issue 23 https://doi.org/10.1103/PhysRevLett.113.237402	journal	December 2014
Hole-induced electronic and optical transitions in $L a_{1 - x} S r_{x} Fe O_{3}$ epitaxial thin films Wang, Le; Du, Yingge; Sushko, Peter V. Physical Review Materials, Vol. 3, Issue 2 https://doi.org/10.1103/PhysRevMaterials.3.025401	journal	February 2019
Creating emergent phenomena in oxide superlattices Ramesh, Ramamoorthy; Schlom, Darrell G. Nature Reviews Materials https://doi.org/10.1038/s41578-019-0095-2	journal	March 2019
Quantum confinement induced magnetism in LaNiO $_{3}$ -LaMnO $_{3}$ superlattices Dong, Shuai; Dagotto, Elbio Physical Review B, Vol. 87, Issue 19 https://doi.org/10.1103/PhysRevB.87.195116	journal	May 2013
A Ferrite Synaptic Transistor with Topotactic Transformation Ge, Chen; Liu, Chang‐xiang; Zhou, Qing‐li Advanced Materials, Vol. 31, Issue 19 https://doi.org/10.1002/adma.201900379	journal	March 2019
Charge Disproportionation without Charge Transfer in the Rare-Earth-Element Nickelates as a Possible Mechanism for the Metal-Insulator Transition Johnston, Steve; Mukherjee, Anamitra; Elfimov, Ilya Physical Review Letters, Vol. 112, Issue 10 https://doi.org/10.1103/PhysRevLett.112.106404	journal	March 2014
Interfacial Control of Magnetic Properties at LaMnO ₃ /LaNiO ₃ Interfaces Gibert, M.; Viret, M.; Torres-Pardo, A. Nano Letters, Vol. 15, Issue 11 https://doi.org/10.1021/acs.nanolett.5b02720	journal	October 2015
Site-Selective Mott Transition in Rare-Earth-Element Nickelates Park, Hyowon; Millis, Andrew J.; Marianetti, Chris A. Physical Review Letters, Vol. 109, Issue 15 https://doi.org/10.1103/PhysRevLett.109.156402	journal	October 2012
Rare-earth nickelates R NiO ₃ : thin films and heterostructures Catalano, S.; Gibert, M.; Fowlie, J. Reports on Progress in Physics, Vol. 81, Issue 4 https://doi.org/10.1088/1361-6633/aaa37a	journal	February 2018
Interfacial Ferromagnetism in ${LaNiO}_{3} / {CaMnO}_{3}$ Superlattices Grutter, A. J.; Yang, H.; Kirby, B. J. Physical Review Letters, Vol. 111, Issue 8 https://doi.org/10.1103/PhysRevLett.111.087202	journal	August 2013
Bond disproportionation and dynamical charge fluctuations in the perovskite rare-earth nickelates Green, R. J.; Haverkort, M. W.; Sawatzky, G. A. Physical Review B, Vol. 94, Issue 19 https://doi.org/10.1103/PhysRevB.94.195127	journal	November 2016
Emergent phenomena at oxide interfaces Hwang, H. Y.; Iwasa, Y.; Kawasaki, M. Nature Materials, Vol. 11, Issue 2 https://doi.org/10.1038/nmat3223	journal	January 2012
Exchange bias in LaNiO3–LaMnO3 superlattices Gibert, Marta; Zubko, Pavlo; Scherwitzl, Raoul Nature Materials, Vol. 11, Issue 3 https://doi.org/10.1038/nmat3224	journal	January 2012
Deciphering the oxygen absorption pre‐edge: a caveat on its application for probing oxygen redox reactions in batteries Roychoudhury, Subhayan; Qiao, Ruimin; Zhuo, Zengqing ENERGY & ENVIRONMENTAL MATERIALS https://doi.org/10.1002/eem2.12119	journal	August 2020
Electronic structure of negative charge transfer ${CaFeO}_{3}$ across the metal-insulator transition Rogge, Paul C.; Chandrasena, Ravini U.; Cammarata, Antonio Physical Review Materials, Vol. 2, Issue 1 https://doi.org/10.1103/PhysRevMaterials.2.015002	journal	January 2018
Tunable Quasi-Two-Dimensional Electron Gases in Oxide Heterostructures Thiel, S. Science, Vol. 313, Issue 5795, p. 1942-1945 https://doi.org/10.1126/science.1131091	journal	September 2006
Direct Experimental Probe of the Ni(II)/Ni(III)/Ni(IV) Redox Evolution in LiNi _0.5 Mn _1.5 O ₄ Electrodes Qiao, Ruimin; Wray, L. Andrew; Kim, Jung-Hyun The Journal of Physical Chemistry C, Vol. 119, Issue 49 https://doi.org/10.1021/acs.jpcc.5b07479	journal	November 2015
Synthesis of SrNiO3 and related compound, Sr2Ni2O5 Takeda, Y.; Hashino, T.; Miyamoto, H. Journal of Inorganic and Nuclear Chemistry, Vol. 34, Issue 5 https://doi.org/10.1016/0022-1902(72)80280-X	journal	May 1972
Direct observation of a two-dimensional hole gas at oxide interfaces Lee, H.; Campbell, N.; Lee, J. Nature Materials, Vol. 17, Issue 3 https://doi.org/10.1038/s41563-017-0002-4	journal	February 2018
Structurally triggered metal-insulator transition in rare-earth nickelates Mercy, Alain; Bieder, Jordan; Íñiguez, Jorge Nature Communications, Vol. 8, Issue 1 https://doi.org/10.1038/s41467-017-01811-x	journal	November 2017
X-ray spectroscopic study of $BaFeO_{3}$ thin films: An ${Fe}^{4 +}$ ferromagnetic insulator Tsuyama, T.; Matsuda, T.; Chakraverty, S. Physical Review B, Vol. 91, Issue 11 https://doi.org/10.1103/PhysRevB.91.115101	journal	March 2015
Band structure and optical transitions in LaFeO ₃ : theory and experiment Scafetta, Mark D.; Cordi, Adam M.; Rondinelli, James M. Journal of Physics: Condensed Matter, Vol. 26, Issue 50 https://doi.org/10.1088/0953-8984/26/50/505502	journal	November 2014
Valence state of the Fe ions in Sr1−yLayFeO3 Takano, M.; Kawachi, J.; Nakanishi, N. Journal of Solid State Chemistry, Vol. 39, Issue 1 https://doi.org/10.1016/0022-4596(81)90304-2	journal	August 1981
Artificial charge-modulationin atomic-scale perovskite titanate superlattices Ohtomo, A.; Muller, D. A.; Grazul, J. L. Nature, Vol. 419, Issue 6905 https://doi.org/10.1038/nature00977	journal	September 2002
Quantitative probe of the transition metal redox in battery electrodes through soft x-ray absorption spectroscopy Li, Qinghao; Qiao, Ruimin; Wray, L. Andrew Journal of Physics D: Applied Physics, Vol. 49, Issue 41 https://doi.org/10.1088/0022-3727/49/41/413003	journal	September 2016

Similar Records

Spontaneous phase segregation of Sr ₂ NiO ₃ and SrNi ₂ O ₃ during SrNiO ₃ heteroepitaxy

Journal Article · Fri Mar 05 00:00:00 EST 2021 · Science Advances · OSTI ID:1763017

Wang, Le; Yang, Zhenzhong; Yin, Xinmao; +13 more

Electronic and protonic conduction in LaFeO ₃

Journal Article · Sun Jan 01 00:00:00 EST 2017 · J. Mater. Chem. A · OSTI ID:1763017

Zhu, Zhen; Peelaers, Hartwin; Van de Walle, Chris G.

Robust half-metallicity of hexagonal SrNiO{sub 3}

Journal Article · Fri Jan 15 00:00:00 EST 2016 · Journal of Solid State Chemistry · OSTI ID:1763017

Chen, Gao-Yuan; Ma, Chun-Lan; Chen, Da; +1 more

Related Subjects

36 MATERIALS SCIENCE
charge transfer
octahedral rotation
Ni4+
Fe4+
superlattices

Title: Hole-Trapping-Induced Stabilization of Ni4+ in SrNiO3/LaFeO3 Superlattices

Citation Formats

References (49)

Similar Records

Related Subjects

Title: Hole-Trapping-Induced Stabilization of Ni⁴⁺ in SrNiO₃/LaFeO₃ Superlattices