The DOI matches its Crossref record; 60 of the 60 references it cites were found in a registry or an index.
Interface Stability in Solid-State Batteries
Open accessAbstract
Development of high conductivity solid-state electrolytes for lithium ion batteries has proceeded rapidly in recent years, but incorporating these new materials into high-performing batteries has proven difficult. Interfacial resistance is now the limiting factor in many systems, but the exact mechanisms of this resistance have not been fully explained - in part because experimental evaluation of the interface can be very difficult. In this work, we develop a computational methodology to examine the thermodynamics of formation of resistive interfacial phases. The predicted interfacial phase formation is well correlated with experimental interfacial observations and battery performance. We calculate that thiophosphate electrolytes have especially high reactivity with high voltage cathodes and a narrow electrochemical stability window. We also find that a number of known electrolytes are not inherently stable but react in situ with the electrode to form passivating but ionically conducting barrier layers. As a reference for experimentalists, we tabulate the stability and expected decomposition products for a wide range of electrolyte, coating, and electrode materials including a number of high-performing combinations that have not yet been attempted experimentally.
Overview
Integrity signals
Registry
Cites
Statistics
Verification
Claims the paper makes
Claims other papers make about this one
Each is checked against this paper’s own text: does it say what the citing paper says it does?
In the citing paper
“This points to an interesting contraindication in materials design: soft anions such as Te2– and I– readily permit cation transport but do not possess the requisite electrochemical (redox) stability for use as solid electrolytes. Conversely, hard anions such as O2– and F– are redox-stable, but they bind cations strongly, and the resulting materials usually display limited ionic conductivity.”
From Artificial Intelligence Driving Materials Discovery? Perspective on the Article: Scaling Deep Learning for Materials Discovery (2024) · cites this paper as [29]
Citations
Cites
Generalized Gradient Approximation Made Simple
Perdew, J. P., Burke, K., & Ernzerhof, M. (1996) · Physical Review Letters · doi:10.1103/physrevlett.77.3865 · Cited by 215,824
Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set
Kresse, G., & Furthmüller, J. (1996) · Physical Review B · doi:10.1103/physrevb.54.11169 · Cited by 123,652
Projector augmented-wave method
Blöchl, P. E. (1994) · Physical Review B · doi:10.1103/physrevb.50.17953 · Cited by 92,732
Electron-energy-loss spectra and the structural stability of nickel oxide: An LSDA+U study
Dudarev, S. L., Botton, G. A., Savrasov, S. Y., Humphreys, C. J., & Sutton, A. P. (1998) · Physical review. B, Condensed matter · doi:10.1103/physrevb.57.1505 · Cited by 15,260
Commentary: The Materials Project: A materials genome approach to accelerating materials innovation
Jain, A., Ong, S. P., Hautier, G., Chen, W., Richards, W. D., Dacek, S., Cholia, S., Gunter, D., Skinner, D., Ceder, G., et al. (2013) · APL Materials · doi:10.1063/1.4812323 · Cited by 13,094
Self-citationBand theory and Mott insulators: Hubbard U instead of Stoner I
Anisimov, V. I., Zaanen, J., & Andersen, O. K. (1991) · Physical review. B, Condensed matter · doi:10.1103/physrevb.44.943 · Cited by 7,492
A lithium superionic conductor
Kamaya, N., Homma, K., Yamakawa, Y., Hirayama, M., Kanno, R., Yonemura, M., Kamiyama, T., Kato, Y., Hama, S., Kawamoto, K., et al. (2011) · Nature Materials · doi:10.1038/nmat3066 · Cited by 4,997
Python Materials Genomics (pymatgen): A robust, open-source python library for materials analysis
Ong, S. P., Richards, W. D., Jain, A., Hautier, G., Kocher, M., Cholia, S., Gunter, D., Chevrier, V. L., Persson, K. A., & Ceder, G. (2013) · Computational Materials Science · doi:10.1016/j.commatsci.2012.10.028 · Cited by 4,534
Self-citationNIST-JANAF Thermochemical Tables
Chase, M. W. (1998) · Medical Entomology and Zoology · Cited by 3,312
Fast Lithium Ion Conduction in Garnet‐Type Li 7 La 3 Zr 2 O 12
Murugan, R., Thangadurai, V., & Weppner, W. (2007) · Angewandte Chemie International Edition · doi:10.1002/anie.200701144 · Cited by 3,304
Garnet-type solid-state fast Li ion conductors for Li batteries: critical review
Thangadurai, V., Narayanan, S., & Pinzaru, D. (2014) · Chemical Society Reviews · doi:10.1039/c4cs00020j · Cited by 1,560
Belsky, A., Hellenbrandt, M., Karen, V. L., & Luksch, P. (2002) · Acta Crystallographica Section B Structural Science · doi:10.1107/s0108768102006948 · Cited by 1,379
Formation enthalpies by mixing GGA and GGA + U calculations
Jain, A., Hautier, G., Ong, S. P., Moore, C. J., Fischer, C. C., Persson, K. A., & Ceder, G. (2011) · Physical Review B · doi:10.1103/physrevb.84.045115 · Cited by 1,355
Self-citationSeino, Y., Ota, T., Takada, K., Hayashi, A., & Tatsumisago, M. (2013) · Energy & Environmental Science · doi:10.1039/c3ee41655k · Cited by 1,311
Progress and prospective of solid-state lithium batteries
Takada, K. (2013) · Acta Materialia · doi:10.1016/j.actamat.2012.10.034 · Cited by 1,067
Ionic Conductivity of Solid Electrolytes Based on Lithium Titanium Phosphate
Aono, H., Sugimoto, E., Sadaoka, Y., Imanaka, N., & Adachi, G. (1990) · Journal of The Electrochemical Society · doi:10.1149/1.2086597 · Cited by 927
Ohta, N., Takada, K., Zhang, L., Ma, R., Osada, M., & Sasaki, T. (2006) · Advanced Materials · doi:10.1002/adma.200502604 · Cited by 900
Anomalous High Ionic Conductivity of Nanoporous β-Li3PS4
Liu, Z., Fu, W., Payzant, E. A., Yu, X., Wu, Z., Dudney, N. J., Kiggans, J., Hong, K., Rondinone, A. J., & Liang, C. (2013) · Journal of the American Chemical Society · doi:10.1021/ja3110895 · Cited by 888
Li−Fe−P−O 2 Phase Diagram from First Principles Calculations
Ong, S. P., Wang, L., Kang, B., & Ceder, G. (2008) · Chemistry of Materials · doi:10.1021/cm702327g · Cited by 813
Self-citationA Stable Thin‐Film Lithium Electrolyte: Lithium Phosphorus Oxynitride
Yu, X., Bates, J. B., Jellison, G. E., & Hart, F. X. (1997) · Journal of The Electrochemical Society · doi:10.1149/1.1837443 · Cited by 806
Solid Electrolyte: the Key for High‐Voltage Lithium Batteries
Li, J., Ma, C., Chi, M., Liang, C., & Dudney, N. J. (2014) · Advanced Energy Materials · doi:10.1002/aenm.201401408 · Cited by 716
Ong, S. P., Mo, Y., Richards, W. D., Miara, L. J., Lee, H. S., & Ceder, G. (2012) · Energy & Environmental Science · doi:10.1039/c2ee23355j · Cited by 711
Self-citationHigh lithium ionic conductivity in the garnet-type oxide Li7−X La3(Zr2−X, NbX)O12 (X=0–2)
Ohta, S., Kobayashi, T., & Asaoka, T. (2010) · Journal of Power Sources · doi:10.1016/j.jpowsour.2010.11.089 · Cited by 680
Sakuda, A., Hayashi, A., & Tatsumisago, M. (2009) · Chemistry of Materials · doi:10.1021/cm901819c · Cited by 661
Li10SnP2S12: An Affordable Lithium Superionic Conductor
Bron, P., Johansson, S., Zick, K., der Günne, J. S. A., Dehnen, S., & Roling, B. (2013) · Journal of the American Chemical Society · doi:10.1021/ja407393y · Cited by 654
Phase Transformations in Metals and Alloys
Meyrick, G., & Powell, G. W. (1973) · Annual Review of Materials Science · doi:10.1146/annurev.ms.03.080173.001551 · Cited by 625
Hautier, G., Fischer, C. C., Jain, A., Mueller, T., & Ceder, G. (2010) · Chemistry of Materials · doi:10.1021/cm100795d · Cited by 580
Self-citationEffect of substitution (Ta, Al, Ga) on the conductivity of Li7La3Zr2O12
Allen, J. L., Wolfenstine, J., Rangasamy, E., & Sakamoto, J. S. (2012) · Journal of Power Sources · doi:10.1016/j.jpowsour.2012.01.131 · Cited by 522
Hautier, G., Ong, S. P., Jain, A., Moore, C. J., & Ceder, G. (2012) · Physical Review B · doi:10.1103/physrevb.85.155208 · Cited by 506
Self-citationTatsumisago, M., Nagao, M., & Hayashi, A. (2013) · Journal of Asian Ceramic Societies · doi:10.1016/j.jascer.2013.03.005 · Cited by 471
Air-stable, high-conduction solid electrolytes of arsenic-substituted Li 4 SnS 4
Sahu, G., Lin, Z., Li, J., Liu, Z., Dudney, N. J., & Liang, C. (2013) · Energy & Environmental Science · doi:10.1039/c3ee43357a · Cited by 435
Interfacial modification for high-power solid-state lithium batteries
Takada, K., Ohta, N., Zhang, L., Fukuda, K., Sakaguchi, I., Ma, R., Osada, M., & Sasaki, T. (2008) · Solid State Ionics · doi:10.1016/j.ssi.2008.02.017 · Cited by 376
A Battery Made from a Single Material
Han, F., Gao, T., Zhu, Y., Gaskell, K. J., & Wang, C. (2015) · Advanced Materials · doi:10.1002/adma.201500180 · Cited by 375
Ionic conductivity of and phase transition in lithium thiophosphate Li3PS4
Tachez, M., Malugani, J. P., Mercier, R., & ROBERT, G. (1984) · Solid State Ionics · doi:10.1016/0167-2738(84)90097-3 · Cited by 358
An Iodide-Based Li7P2S8I Superionic Conductor
Rangasamy, E., Liu, Z., Gobet, M. P., Pilar, K., Sahu, G., Zhou, W., Wu, H., Greenbaum, S., & Liang, C. (2015) · Journal of the American Chemical Society · doi:10.1021/ja508723m · Cited by 353
Kuhn, A., Gerbig, O., Zhu, C., Falkenberg, F., Maier, J., & Lotsch, B. V. (2014) · Physical Chemistry Chemical Physics · doi:10.1039/c4cp02046d · Cited by 319
Tetragonal Li10GeP2S12 and Li7GePS8 – exploring the Li ion dynamics in LGPS Li electrolytes
Kuhn, A., Düppel, V., & Lotsch, B. V. (2013) · Energy & Environmental Science · doi:10.1039/c3ee41728j · Cited by 291
Interface reactions between LiPON and lithium studied by in-situ X-ray photoemission
Schwöbel, A., Hausbrand, R., & Jaegermann, W. (2014) · Solid State Ionics · doi:10.1016/j.ssi.2014.10.017 · Cited by 271
Ohta, S., Seki, J., Yagi, Y., Kihira, Y., Tani, T., & Asaoka, T. (2014) · Journal of Power Sources · doi:10.1016/j.jpowsour.2014.04.065 · Cited by 268
Blundell, S. J. (2001) · doi:10.1093/oso/9780198505921.005.0005 · Cited by 248
Phase Transformations in Metals and Alloys -2nd ed.-
Porter, D. A., & Easterling, K. E. (1992) · Cited by 244
Interfacial phenomena in solid-state lithium battery with sulfide solid electrolyte
Takada, K., Ohta, N., Zhang, L., Xu, X., Hang, B. T., Ohnishi, T., Osada, M., & Sasaki, T. (2012) · Solid State Ionics · doi:10.1016/j.ssi.2012.01.009 · Cited by 205
Empowering the Lithium Metal Battery through a Silicon-Based Superionic Conductor
Whiteley, J. M., Woo, J. H., Hu, E., Nam, K., & Lee, S.-H. (2014) · Journal of The Electrochemical Society · doi:10.1149/2.0501412jes · Cited by 192
Ion transport in sodium ion conducting solid electrolytes
Fergus, J. W. (2012) · Solid State Ionics · doi:10.1016/j.ssi.2012.09.019 · Cited by 183
All-solid-state lithium battery with LiBH4 solid electrolyte
Takahashi, K., Hattori, K., Yamazaki, T., Takada, K., Matsuo, M., Orimo, S., Maekawa, H., & Takamura, H. (2012) · Journal of Power Sources · doi:10.1016/j.jpowsour.2012.10.079 · Cited by 157
Preparation, structure and ionic conductivity of lithium phosphide
Nazri, G. A. (1989) · Solid State Ionics · doi:10.1016/0167-2738(89)90438-4 · Cited by 150
A new crystalline LiPON electrolyte: Synthesis, properties, and electronic structure
Senevirathne, K., Day, C. S., Gross, M. D., Lachgar, A., & Holzwarth, N. A. W. (2013) · Solid State Ionics · doi:10.1016/j.ssi.2012.12.013 · Cited by 149
Nanocrystalline Li x Mn2 − y O 4 Cathodes for Solid‐State Thin‐Film Rechargeable Lithium Batteries
Dudney, N. J., Bates, J. B., Zuhr, R. A., Young, S. D., Robertson, J. D., Jun, H. P., & Hackney, S. A. (1999) · Journal of The Electrochemical Society · doi:10.1149/1.1391955 · Cited by 148
Materials Thermochemistry - 6th ed.-
Kubaschewski, O., Alcock, C. B., & Spencer, P. J. (1993) · RWTH Publications (RWTH Aachen) · Cited by 146
High Power Nanocomposite TiS2 Cathodes for All-Solid-State Lithium Batteries
Trevey, J. E., Stoldt, C. R., & Lee, S.-H. (2011) · Journal of The Electrochemical Society · doi:10.1149/2.017112jes · Cited by 129
TEMPERATURE-CONDUCTANCE CURVES OF SOLID SALTS. III. HALIDES OF LITHIUM
Ginnings, D. C., & Phipps, T. E. (1930) · Journal of the American Chemical Society · doi:10.1021/ja01367a006 · Cited by 94
Ionic conductivity of alkali metal chloroaluminates
Weppner, W., & Huggins, R. A. (1976) · Physics Letters A · doi:10.1016/0375-9601(76)90087-6 · Cited by 83
Kanno, R., Takeda, Y., & Yamamoto, O. (1981) · Materials Research Bulletin · doi:10.1016/0025-5408(81)90142-2 · Cited by 82
Optimization of NASICON composition for Na+ recognition
Khireddine, H., Fabry, P., Caneiro, A., & Bochu, B. (1997) · Sensors and Actuators B Chemical · doi:10.1016/s0925-4005(97)80266-3 · Cited by 69
Some chlorides with the inverse spinel structure
van Loon, C. J. J., & de Jong, J. (1975) · Acta Crystallographica Section B · doi:10.1107/s0567740875008114 · Cited by 64
Ionic Conductivity in Lithium and Lithium‐Sodium Beta Alumina
Briant, J. L., & FARRINGTON, G. C. (1981) · Journal of The Electrochemical Society · doi:10.1149/1.2127746 · Cited by 58
Measurement of ionic diffusion in lithium fluoride by nuclear magnetic resonance techniques
Stoebe, T. G., & Huggins, R. A. (1966) · Journal of Materials Science · doi:10.1007/bf00550100 · Cited by 55
Structure, ionic motion and conductivity in some solid-solutions of the LiClMCl2 systems (M=Mg,V,Mn)
Cros, C., Hanebali, L., Latie, L., Villeneuve, G., & GANG, W. (1983) · Solid State Ionics · doi:10.1016/0167-2738(83)90223-0 · Cited by 48
Hoshina, K., Dokko, K., & Kanamura, K. (2005) · Journal of The Electrochemical Society · doi:10.1149/1.2041967 · Cited by 46
Ionic Conductivity and Phase Transition of the Bromide Spinels, Li2 − 2x M 1 + x Br4 ( M = Mg , Mn )
Kanno, R., Takeda, Y., Yamamoto, O., Cros, C., Gang, W., & Hagenmuller, P. (1986) · Journal of The Electrochemical Society · doi:10.1149/1.2108704 · Cited by 31
Flagged first, then by citations
Research works printed but not linked: 1
- Kubaschewski, 1993, Materials Thermochemistry
Cited by
Sorted by citations
Toward Safe Lithium Metal Anode in Rechargeable Batteries: A Review
Cheng, X., Zhang, R., Zhao, C., & Zhang, Q. (2017) · Chemical Reviews · doi:10.1021/acs.chemrev.7b00115 · Cited by 6,257
A solid future for battery development
Janek, J., & Zeier, W. G. (2016) · Nature Energy · doi:10.1038/nenergy.2016.141 · Cited by 3,979
Fundamentals of inorganic solid-state electrolytes for batteries
Famprikis, T., Canepa, P., Dawson, J. A., Islam, M. S., & Masquelier, C. (2019) · Nature Materials · doi:10.1038/s41563-019-0431-3 · Cited by 2,601
Chen, R., Li, Q., Yu, X., Chen, L., & Li, H. (2019) · Chemical Reviews · doi:10.1021/acs.chemrev.9b00268 · Cited by 1,693
Tian, Y., Zeng, G., Rutt, A., Shi, T., Kim, H., Wang, J., Koettgen, J., Sun, Y., Ouyang, B., Chen, T., et al. (2020) · Chemical Reviews · doi:10.1021/acs.chemrev.0c00767 · Cited by 1,639
Self-citation
Metadata
- Authors
- Richards, W. D., Miara, L. J., Wang, Y., Kim, J. C., & Ceder, G.
- Affiliations
- Massachusetts Institute of Technology (US)
- Samsung Advanced Institute of Technology - USA , 255 Main Street, Suite 702 , , ,
- Lawrence Berkeley National Laboratory (US)
- Corresponding author
- Ceder, Gerbrand
- Venue
- Chemistry of Materials
- Publisher
- American Chemical Society (ACS)
- Published
- 2015-12-07
- Volume
- 28
- Issue
- 1
- Pages
- 266-273
- ISSN
- 0897-4756 (ISSN-L)
- 1520-5002
- OpenAlex
- W2237868774
- Cited by
- 1,652
- References
- 60
- Citations by year
- 2026: 156 · 2025: 188 · 2024: 181 · 2023: 199 · 2022: 204 · 2021: 196 · 2020: 173 · 2019: 141 · 2018: 112 · 2017: 74 · 2016: 28
- FWCI
- 33.24
- Type
- journal article
- Language
- en
- Open access
- hybrid
- doi.org
- Locations
- Chemistry of Materials (publishedVersion, other-oa)
- DSpace@MIT (Massachusetts Institute of Technology) (submittedVersion, cc-by-nc)
- Funders
- Samsung (NA)
- Topics
- Physical Sciences › Engineering › Electrical and Electronic Engineering › Advanced Battery Materials and Technologies
- Physical Sciences › Engineering › Electrical and Electronic Engineering › Advancements in Battery Materials
- Physical Sciences › Materials Science › Materials Chemistry › Thermal Expansion and Ionic Conductivity
- Keywords
- solid-state batteries, solid electrolytes, interfacial resistance, interfacial stability, interfacial phase formation, high-voltage cathodes, electrochemical stability window, electrolyte decomposition products, lithium-ion batteries
About these checks
Registry, retraction, Cites and statistics results are computed, not judged, with one exception: a printed reference that no index lists is read once by a model before it counts as a citation error. Claims are extracted by a model and kept only when their quote appears verbatim in the text; each cited source is then checked, with a model’s help, for whether it says what the claim relies on. Those verdicts can be wrong — read the claim’s quote and the cited source before relying on one.
Statistics and arithmetic are recomputed, not judged.
Confidence bands are shown only for fields calibrated on our annotated test set. None is calibrated yet, so no band is shown.
What counts as a claim ›How we measure confidence ›How we check this ›
Are you an author, or do you see a problem with this page? Request a review
