Single-phase local-high-concentration solid polymer electrolytes for lithium-metal batteries

Zhang, Weiran; Koverga, Volodymyr; Liu, Sufu; Zhou, Jigang; Wang, Jian; Bai, Panxing; Tan, Sha; Dandu, Naveen K.; Wang, Zeyi; Chen, Fu; Xia, Jiale; Wan, Hongli; Zhang, Xiyue; Yang, Haochen; Lucht, Brett L.; Li, Ai-Min; Yang, Xiao-Qing; Hu, Enyuan; Raghavan, Srinivasa R.; Ngo, Anh T.; Wang, Chunsheng

doi:10.1038/s41560-023-01443-0

Title: Single-phase local-high-concentration solid polymer electrolytes for lithium-metal batteries

Journal Article · Fri Jan 12 00:00:00 EST 2024 · Nature Energy

DOI:https://doi.org/10.1038/s41560-023-01443-0· OSTI ID:2283303

Zhang, Weiran ^[1]; Koverga, Volodymyr ^[2]; Liu, Sufu ^[1];

^[3];

^[3]; Bai, Panxing ^[1];

^[4]; Dandu, Naveen K. ^[2]; Wang, Zeyi ^[1];

^[1];

^[5]; Li, Ai-Min ^[1];

^[4];

^[1];

^[2] more »

University of Maryland, College Park, MD (United States)
Argonne National Laboratory (ANL), Argonne, IL (United States); University of Illinois Chicago, IL (United States)
University of Saskatchewan, Saskatoon (Canada)
Brookhaven National Laboratory (BNL), Upton, NY (United States)
University of Rhode Island, Kingston, RI (United States)

Solid polymers are promising electrolytes for Li-metal batteries, but they have limitations: they cannot simultaneously achieve high ionic conductivity, good mechanical strength and compatibility with high-voltage cathodes while suppressing Li dendrites. Here, we design a class of locally high-concentration solid polymer electrolytes based on polymer blends, which are termed Li-polymer in F diluter (LPIFD). The Li-polymer (polymer-in-salt) ensures continuous Li-ion conduction channels and contributes to the solid electrolyte interphase (SEI), and the F diluter (inert fluorinated polymer) adds mechanical strength. Studies reveal that a single-phase LPIFD, which is based on a miscible polymer blend, lacks phase boundaries and forms an organic-less and LiF-rich SEI, effectively suppressing lithium dendrites. The single-phase LPIFD delivers ionic conductivity of 3.0 x 10^-4 S cm^-1 and enables the Li anode to reach a high coulombic efficiency of 99.1% and a critical current density of 3.7 mA cm^-2. Furthermore, the ability to form an F-rich cathode electrolyte interphase allows LiNi_0.8Co_0.1Mn_0.1O₂||Li cells to achieve a cycle life of 450 cycles at a high operating voltage of 4.5 V. In conclusion, this design will inspire efforts to commercialize polymer electrolytes for high-energy Li-metal batteries.

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Research Organization:: Brookhaven National Laboratory (BNL), Upton, NY (United States); Univ. of Maryland, College Park, MD (United States)

Sponsoring Organization:: USDOE Office of Energy Efficiency and Renewable Energy (EERE), Office of Sustainable Transportation. Vehicle Technologies Office (VTO); USDOE Office of Science (SC), Basic Energy Sciences (BES). Scientific User Facilities (SUF); National Science Foundation (NSF)

Grant/Contract Number:: SC0012704; EE0008856; AC05-76RL01830; EE0009183; NSF-1726058

OSTI ID:: 2283303

Report Number(s):: BNL-225238-2024-JAAM

Journal Information:: Nature Energy, Journal Name: Nature Energy; ISSN 2058-7546

Publisher:: Nature Publishing GroupCopyright Statement

Country of Publication:: United States

Language:: English

References (114)

Reviving the lithium metal anode for high-energy batteries Lin, Dingchang; Liu, Yayuan; Cui, Yi Nature Nanotechnology, Vol. 12, Issue 3 https://doi.org/10.1038/nnano.2017.16	journal	March 2017
Stable lithium electrodeposition in liquid and nanoporous solid electrolytes Lu, Yingying; Tu, Zhengyuan; Archer, Lynden A. Nature Materials, Vol. 13, Issue 10 https://doi.org/10.1038/nmat4041	journal	August 2014
Questions and Answers Relating to Lithium-Ion Battery Safety Issues Huang, Wensheng; Feng, Xuning; Han, Xuebing Cell Reports Physical Science, Vol. 2, Issue 1 https://doi.org/10.1016/j.xcrp.2020.100285	journal	January 2021
Transition of lithium growth mechanisms in liquid electrolytes Bai, Peng; Li, Ju; Brushett, Fikile R. Energy & Environmental Science, Vol. 9, Issue 10 https://doi.org/10.1039/C6EE01674J	journal	January 2016
The synergetic effect of lithium polysulfide and lithium nitrate to prevent lithium dendrite growth Li, Weiyang; Yao, Hongbin; Yan, Kai Nature Communications, Vol. 6, Issue 1 https://doi.org/10.1038/ncomms8436	journal	June 2015
Direct observation of lithium dendrites inside garnet-type lithium-ion solid electrolyte Ren, Yaoyu; Shen, Yang; Lin, Yuanhua Electrochemistry Communications, Vol. 57 https://doi.org/10.1016/j.elecom.2015.05.001	journal	August 2015
Nonaqueous Liquid Electrolytes for Lithium-Based Rechargeable Batteries Xu, Kang Chemical Reviews, Vol. 104, Issue 10, p. 4303-4418 https://doi.org/10.1021/cr030203g	journal	October 2004
Toward Safe Lithium Metal Anode in Rechargeable Batteries: A Review Cheng, Xin-Bing; Zhang, Rui; Zhao, Chen-Zi Chemical Reviews, Vol. 117, Issue 15 https://doi.org/10.1021/acs.chemrev.7b00115	journal	July 2017
In Situ Solid Electrolyte Interphase from Spray Quenching on Molten Li: A New Way to Construct High‐Performance Lithium‐Metal Anodes Liu, Sufu; Xia, Xinhui; Deng, Shengjue Advanced Materials, Vol. 31, Issue 3 https://doi.org/10.1002/adma.201806470	journal	September 2018
A Review of Existing and Emerging Methods for Lithium Detection and Characterization in Li‐Ion and Li‐Metal Batteries Paul, Partha P.; McShane, Eric J.; Colclasure, Andrew M. Advanced Energy Materials, Vol. 11, Issue 17 https://doi.org/10.1002/aenm.202100372	journal	March 2021
Semi-solid alkali metal electrodes enabling high critical current densities in solid electrolyte batteries Park, Richard J. -Y.; Eschler, Christopher M.; Fincher, Cole D. Nature Energy, Vol. 6, Issue 3 https://doi.org/10.1038/s41560-021-00786-w	journal	March 2021
Fluorinated solid electrolyte interphase enables highly reversible solid-state Li metal battery Fan, Xiulin; Ji, Xiao; Han, Fudong Science Advances, Vol. 4, Issue 12 https://doi.org/10.1126/sciadv.aau9245	journal	December 2018
Solid‐State Electrolyte Design for Lithium Dendrite Suppression Ji, Xiao; Hou, Singyuk; Wang, Pengfei Advanced Materials, Vol. 32, Issue 46 https://doi.org/10.1002/adma.202002741	journal	October 2020
Rational design of spontaneous reactions for protecting porous lithium electrodes in lithium–sulfur batteries Ren, Y. X.; Zeng, L.; Jiang, H. R. Nature Communications, Vol. 10, Issue 1 https://doi.org/10.1038/s41467-019-11168-y	journal	July 2019
Non-flammable electrolyte enables Li-metal batteries with aggressive cathode chemistries Fan, Xiulin; Chen, Long; Borodin, Oleg Nature Nanotechnology, Vol. 13, Issue 8 https://doi.org/10.1038/s41565-018-0183-2	journal	July 2018
Superconcentrated electrolytes for a high-voltage lithium-ion battery Wang, Jianhui; Yamada, Yuki; Sodeyama, Keitaro Nature Communications, Vol. 7, Issue 1 https://doi.org/10.1038/ncomms12032	journal	June 2016
Review—Superconcentrated Electrolytes for Lithium Batteries Yamada, Yuki; Yamada, Atsuo Journal of The Electrochemical Society, Vol. 162, Issue 14 https://doi.org/10.1149/2.0041514jes	journal	January 2015
Electrolyte design for LiF-rich solid–electrolyte interfaces to enable high-performance microsized alloy anodes for batteries Chen, Ji; Fan, Xiulin; Li, Qin Nature Energy, Vol. 5, Issue 5 https://doi.org/10.1038/s41560-020-0601-1	journal	April 2020
Highly Fluorinated Interphases Enable High-Voltage Li-Metal Batteries Fan, Xiulin; Chen, Long; Ji, Xiao Chem, Vol. 4, Issue 1 https://doi.org/10.1016/j.chempr.2017.10.017	journal	January 2018
Monolithic solid–electrolyte interphases formed in fluorinated orthoformate-based electrolytes minimize Li depletion and pulverization Cao, Xia; Ren, Xiaodi; Zou, Lianfeng Nature Energy, Vol. 4, Issue 9 https://doi.org/10.1038/s41560-019-0464-5	journal	September 2019
Localized High-Concentration Sulfone Electrolytes for High-Efficiency Lithium-Metal Batteries Ren, Xiaodi; Chen, Shuru; Lee, Hongkyung Chem, Vol. 4, Issue 8 https://doi.org/10.1016/j.chempr.2018.05.002	journal	August 2018
Molecular design for electrolyte solvents enabling energy-dense and long-cycling lithium metal batteries Yu, Zhiao; Wang, Hansen; Kong, Xian Nature Energy, Vol. 5, Issue 7 https://doi.org/10.1038/s41560-020-0634-5	journal	June 2020
The Impact of Elastic Deformation on Deposition Kinetics at Lithium/Polymer Interfaces Monroe, Charles; Newman, John Journal of The Electrochemical Society, Vol. 152, Issue 2 https://doi.org/10.1149/1.1850854	journal	January 2005
The Effect of Interfacial Deformation on Electrodeposition Kinetics Monroe, Charles; Newman, John Journal of The Electrochemical Society, Vol. 151, Issue 6 https://doi.org/10.1149/1.1710893	journal	January 2004
Physicochemical Concepts of the Lithium Metal Anode in Solid-State Batteries Krauskopf, Thorben; Richter, Felix H.; Zeier, Wolfgang G. Chemical Reviews, Vol. 120, Issue 15 https://doi.org/10.1021/acs.chemrev.0c00431	journal	July 2020
Lithium Dendrite in All-Solid-State Batteries: Growth Mechanisms, Suppression Strategies, and Characterizations Cao, Daxian; Sun, Xiao; Li, Qiang Matter, Vol. 3, Issue 1 https://doi.org/10.1016/j.matt.2020.03.015	journal	July 2020
Critical Current Density in Solid‐State Lithium Metal Batteries: Mechanism, Influences, and Strategies Lu, Yang; Zhao, Chen‐Zi; Yuan, Hong Advanced Functional Materials, Vol. 31, Issue 18 https://doi.org/10.1002/adfm.202009925	journal	February 2021
Solid-state rigid-rod polymer composite electrolytes with nanocrystalline lithium ion pathways Wang, Ying; Zanelotti, Curt J.; Wang, Xiaoen Nature Materials https://doi.org/10.1038/s41563-021-00995-4	journal	May 2021
Solid-state polymer electrolytes with in-built fast interfacial transport for secondary lithium batteries Zhao, Qing; Liu, Xiaotun; Stalin, Sanjuna Nature Energy, Vol. 4, Issue 5 https://doi.org/10.1038/s41560-019-0349-7	journal	March 2019
Are Polymer‐Based Electrolytes Ready for High‐Voltage Lithium Battery Applications? An Overview of Degradation Mechanisms and Battery Performance Cabañero Martínez, Maria Angeles; Boaretto, Nicola; Naylor, Andrew J. Advanced Energy Materials, Vol. 12, Issue 32 https://doi.org/10.1002/aenm.202201264	journal	July 2022
Characterization of the structure and chemistry of the solid–electrolyte interface by cryo-EM leads to high-performance solid-state Li-metal batteries Lin, Ruoqian; He, Yubin; Wang, Chunyang Nature Nanotechnology, Vol. 17, Issue 7 https://doi.org/10.1038/s41565-022-01148-7	journal	June 2022
Tailoring electrolyte solvation for Li metal batteries cycled at ultra-low temperature Holoubek, John; Liu, Haodong; Wu, Zhaohui Nature Energy, Vol. 6, Issue 3 https://doi.org/10.1038/s41560-021-00783-z	journal	February 2021
Formation of Stable Interphase of Polymer-in-Salt Electrolyte in All-Solid-State Lithium Batteries Gao, Hongcai; Grundish, Nicholas S.; Zhao, Yongjie Energy Material Advances, Vol. 2021 https://doi.org/10.34133/2021/1932952	journal	January 2021
Cationic polymer-in-salt electrolytes for fast metal ion conduction and solid-state battery applications Chen, Fangfang; Wang, Xiaoen; Armand, Michel Nature Materials, Vol. 21, Issue 10 https://doi.org/10.1038/s41563-022-01319-w	journal	July 2022
A highly-concentrated poly(ethylene carbonate)-based electrolyte for all-solid-state Li battery working at room temperature Kimura, Kento; Yajima, Mari; Tominaga, Yoichi Electrochemistry Communications, Vol. 66 https://doi.org/10.1016/j.elecom.2016.02.022	journal	May 2016
Versatile Strategy for Realizing Flexible Room-Temperature All-Solid-State Battery through a Synergistic Combination of Salt Affluent PEO and Li_6.75La₃Zr_1.75Ta_0.25O₁₂ Nanofibers Fan, Rong; Liu, Chen; He, Kangqiang ACS Applied Materials & Interfaces, Vol. 12, Issue 6 https://doi.org/10.1021/acsami.9b20104	journal	January 2020
Lithium-Salt-Rich PEO/Li _0.3 La _0.557 TiO ₃ Interpenetrating Composite Electrolyte with Three-Dimensional Ceramic Nano-Backbone for All-Solid-State Lithium-Ion Batteries Wang, Xinzhi; Zhang, Yibo; Zhang, Xue ACS Applied Materials & Interfaces, Vol. 10, Issue 29 https://doi.org/10.1021/acsami.8b06658	journal	July 2018
Reducing the thickness of solid-state electrolyte membranes for high-energy lithium batteries Wu, Jingyi; Yuan, Lixia; Zhang, Wuxing Energy & Environmental Science, Vol. 14, Issue 1 https://doi.org/10.1039/D0EE02241A	journal	January 2021
Ultra-stable all-solid-state sodium metal batteries enabled by perfluoropolyether-based electrolytes Wang, Xiaoen; Zhang, Cheng; Sawczyk, Michal Nature Materials, Vol. 21, Issue 9 https://doi.org/10.1038/s41563-022-01296-0	journal	July 2022
A rational design of solid polymer electrolyte with high salt concentration for lithium battery Zhao, Yanbiao; Bai, Yang; Bai, Yongpin Journal of Power Sources, Vol. 407 https://doi.org/10.1016/j.jpowsour.2018.10.045	journal	December 2018
Recent Advances in Energy Chemistry between Solid-State Electrolyte and Safe Lithium-Metal Anodes Cheng, Xin-Bing; Zhao, Chen-Zi; Yao, Yu-Xing Chem, Vol. 5, Issue 1 https://doi.org/10.1016/j.chempr.2018.12.002	journal	January 2019
High electronic conductivity as the origin of lithium dendrite formation within solid electrolytes Han, Fudong; Westover, Andrew S.; Yue, Jie Nature Energy, Vol. 4, Issue 3 https://doi.org/10.1038/s41560-018-0312-z	journal	January 2019
The role of the solid electrolyte interphase layer in preventing Li dendrite growth in solid-state batteries Wu, Bingbin; Wang, Shanyu; Lochala, Joshua Energy & Environmental Science, Vol. 11, Issue 7 https://doi.org/10.1039/C8EE00540K	journal	January 2018
Phase regulation enabling dense polymer-based composite electrolytes for solid-state lithium metal batteries Wu, Qian; Fang, Mandi; Jiao, Shizhe Nature Communications, Vol. 14, Issue 1 https://doi.org/10.1038/s41467-023-41808-3	journal	October 2023
PVDF–PEO blends based microporous polymer electrolyte: Effect of PEO on pore configurations and ionic conductivity Xi, Jingyu; Qiu, Xinping; Li, Jian Journal of Power Sources, Vol. 157, Issue 1 https://doi.org/10.1016/j.jpowsour.2005.08.009	journal	June 2006
Co-continuity interval in immiscible polymer blends by dynamic mechanical spectroscopy in the molten and solid state Chaput, Sandrine; Carrot, Christian; Castro, Mickael Rheologica Acta, Vol. 43, Issue 5 https://doi.org/10.1007/s00397-004-0369-4	journal	April 2004
Blending-based poly(vinylidene fluoride)/polymethyl methacrylate membrane for rechargeable lithium-ion batteries Liu, Jiuqing; Liu, Meng; He, Chunfeng Ionics, Vol. 25, Issue 11 https://doi.org/10.1007/s11581-019-03060-y	journal	May 2019
3D laser scanning confocal microscopy of siloxane-based comb and double-comb polymers in PVDF-HFP thin films Cznotka, Eva; Jeschke, Steffen; Schmohl, Sebastian Journal of Coatings Technology and Research, Vol. 13, Issue 4 https://doi.org/10.1007/s11998-015-9754-4	journal	January 2016
Polyfluorinated crosslinker-based solid polymer electrolytes for long-cycling 4.5 V lithium metal batteries Tang, Lingfei; Chen, Bowen; Zhang, Zhonghan Nature Communications, Vol. 14, Issue 1 https://doi.org/10.1038/s41467-023-37997-6	journal	April 2023
Self‐Suppression of Lithium Dendrite in All‐Solid‐State Lithium Metal Batteries with Poly(vinylidene difluoride)‐Based Solid Electrolytes Zhang, Xue; Wang, Shuo; Xue, Chuanjiao Advanced Materials, Vol. 31, Issue 11 https://doi.org/10.1002/adma.201806082	journal	January 2019
Designing Polymer‐in‐Salt Electrolyte and Fully Infiltrated 3D Electrode for Integrated Solid‐State Lithium Batteries Liu, Wenyi; Yi, Chengjun; Li, Linpo Angewandte Chemie, Vol. 133, Issue 23 https://doi.org/10.1002/ange.202101537	journal	May 2021
An ion-conductive Li7La3Zr2O12-based composite membrane for dendrite-free lithium metal batteries Zhang, Wenqiang; Yi, Qiang; Li, Shuyuan Journal of Power Sources, Vol. 450 https://doi.org/10.1016/j.jpowsour.2020.227710	journal	February 2020
PVDF-HFP/LiF Composite Interfacial Film to Enhance the Stability of Li-Metal Anodes Guo, Suogang; Piao, Nan; Wang, Li ACS Applied Energy Materials, Vol. 3, Issue 7 https://doi.org/10.1021/acsaem.0c01232	journal	June 2020
Challenges with prediction of battery electrolyte electrochemical stability window and guiding the electrode – electrolyte stabilization Borodin, Oleg Current Opinion in Electrochemistry, Vol. 13 https://doi.org/10.1016/j.coelec.2018.10.015	journal	February 2019
Polyphosphazene membrane for desulfurization: Selecting poly[bis(trifluoroethoxy) phosphazene] for pervaporative removal of thiophene Yang, Zhengjin; Zhang, Weiyu; Li, Jiding Separation and Purification Technology, Vol. 93 https://doi.org/10.1016/j.seppur.2012.03.015	journal	June 2012
Ionic conductivity of polymer electrolyte membranes based on polyphosphazene with oligo(propylene oxide) side chains Kaskhedikar, N.; Paulsdorf, J.; Burjanadze, M. Solid State Ionics, Vol. 177, Issue 7-8 https://doi.org/10.1016/j.ssi.2006.01.011	journal	March 2006
Preparation and electrochemical performance of polyphosphazene based salt-in-polymer electrolyte membranes for lithium ion batteries Jankowsky, S.; Hiller, M. M.; Wiemhöfer, H. -D. Journal of Power Sources, Vol. 253 https://doi.org/10.1016/j.jpowsour.2013.11.120	journal	May 2014
Rational solvent molecule tuning for high-performance lithium metal battery electrolytes Yu, Zhiao; Rudnicki, Paul E.; Zhang, Zewen Nature Energy, Vol. 7, Issue 1 https://doi.org/10.1038/s41560-021-00962-y	journal	January 2022
Decoupling of ion pairing and ion conduction in ultrahigh-concentration electrolytes enables wide-temperature solid-state batteries Xu, Shengjun; Xu, Ruogu; Yu, Tong Energy & Environmental Science, Vol. 15, Issue 8 https://doi.org/10.1039/D2EE01053D	journal	January 2022
Chemical interaction and imaging of single Co3O4/graphene sheets studied by scanning transmission X-ray microscopy and X-ray absorption spectroscopy Wang, Jian; Zhou, Jigang; Hu, Yongfeng Energy & Environmental Science, Vol. 6, Issue 3 https://doi.org/10.1039/c2ee23844f	journal	January 2013
Water Domain Enabled Transport in Polymer Electrolytes for Lithium-Ion Batteries Widstrom, Matthew D.; Borodin, Oleg; Ludwig, Kyle B. Macromolecules, Vol. 54, Issue 6 https://doi.org/10.1021/acs.macromol.0c01960	journal	March 2021
A 63 m Superconcentrated Aqueous Electrolyte for High-Energy Li-Ion Batteries Chen, Long; Zhang, Jiaxun; Li, Qin ACS Energy Letters, Vol. 5, Issue 3 https://doi.org/10.1021/acsenergylett.0c00348	journal	February 2020
Countersolvent Electrolytes for Lithium‐Metal Batteries Piao, Nan; Ji, Xiao; Xu, Hong Advanced Energy Materials, Vol. 10, Issue 10 https://doi.org/10.1002/aenm.201903568	journal	March 2020
X-Ray absorption spectroscopy of LiBF ₄ in propylene carbonate: a model lithium ion battery electrolyte Smith, Jacob W.; Lam, Royce K.; Sheardy, Alex T. Phys. Chem. Chem. Phys., Vol. 16, Issue 43 https://doi.org/10.1039/C4CP03240C	journal	January 2014
Lithium Ion Solvation and Diffusion in Bulk Organic Electrolytes from First-Principles and Classical Reactive Molecular Dynamics Ong, Mitchell T.; Verners, Osvalds; Draeger, Erik W. The Journal of Physical Chemistry B, Vol. 119, Issue 4 https://doi.org/10.1021/jp508184f	journal	January 2015
Molecular-Scale Structure of Electrode–Electrolyte Interfaces: The Case of Platinum in Aqueous Sulfuric Acid Wu, Cheng Hao; Pascal, Tod A.; Baskin, Artem Journal of the American Chemical Society, Vol. 140, Issue 47 https://doi.org/10.1021/jacs.8b09743	journal	October 2018
Critical absorbed dose of resinous adhesive material towards non-destructive chemical-state analysis using soft X-rays Yamane, Hiroyuki; Oura, Masaki; Sawada, Kei Journal of Electron Spectroscopy and Related Phenomena, Vol. 232 https://doi.org/10.1016/j.elspec.2018.12.005	journal	April 2019
In Situ Synthesis of a Hierarchical All-Solid-State Electrolyte Based on Nitrile Materials for High-Performance Lithium-Ion Batteries Zhou, Dong; He, Yan-Bing; Liu, Ruliang Advanced Energy Materials, Vol. 5, Issue 15 https://doi.org/10.1002/aenm.201500353	journal	May 2015
In situ formation of polymer-inorganic solid-electrolyte interphase for stable polymeric solid-state lithium-metal batteries Deng, Tao; Cao, Longsheng; He, Xinzi Chem, Vol. 7, Issue 11 https://doi.org/10.1016/j.chempr.2021.06.019	journal	November 2021
In Situ Formation of Li ₃ P Layer Enables Fast Li ⁺ Conduction across Li/Solid Polymer Electrolyte Interface Wu, Nan; Li, Yutao; Dolocan, Andrei Advanced Functional Materials, Vol. 30, Issue 22 https://doi.org/10.1002/adfm.202000831	journal	April 2020
All-temperature batteries enabled by fluorinated electrolytes with non-polar solvents Fan, Xiulin; Ji, Xiao; Chen, Long Nature Energy, Vol. 4, Issue 10 https://doi.org/10.1038/s41560-019-0474-3	journal	October 2019
Electrolyte design for Li metal-free Li batteries Chen, Ji; Li, Qin; Pollard, Travis P. Materials Today https://doi.org/10.1016/j.mattod.2020.04.004	journal	April 2020
In situ NMR observation of the formation of metallic lithium microstructures in lithium batteries Bhattacharyya, Rangeet; Key, Baris; Chen, Hailong Nature Materials, Vol. 9, Issue 6 https://doi.org/10.1038/nmat2764	journal	May 2010
7Li MRI of Li batteries reveals location of microstructural lithium Chandrashekar, S.; Trease, Nicole M.; Chang, Hee Jung Nature Materials, Vol. 11, Issue 4 https://doi.org/10.1038/nmat3246	journal	February 2012
Li ₇ La ₃ Zr ₂ O ₁₂ Interface Modification for Li Dendrite Prevention Tsai, Chih-Long; Roddatis, Vladimir; Chandran, C. Vinod ACS Applied Materials & Interfaces, Vol. 8, Issue 16 https://doi.org/10.1021/acsami.6b00831	journal	April 2016
An Inorganic‐Rich Solid Electrolyte Interphase for Advanced Lithium‐Metal Batteries in Carbonate Electrolytes Liu, Sufu; Ji, Xiao; Piao, Nan Angewandte Chemie International Edition, Vol. 60, Issue 7 https://doi.org/10.1002/anie.202012005	journal	December 2020
Salt‐in‐Salt Reinforced Carbonate Electrolyte for Li Metal Batteries Liu, Sufu; Xia, Jiale; Zhang, Weiran Angewandte Chemie International Edition, Vol. 61, Issue 43 https://doi.org/10.1002/anie.202210522	journal	September 2022
Electrolytes and Interphases in Li-Ion Batteries and Beyond Xu, Kang Chemical Reviews, Vol. 114, Issue 23 https://doi.org/10.1021/cr500003w	journal	October 2014
New Photoresist Materials for 157-nm Lithography. Poly[Vinylsulfonyl Fluoride-co-4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropyl)-styrene] Partially Protected with tert-Butoxycarbonyl Fujigaya, Tsuyohiko; Sibasaki, Yuji; Ando, Shinji Chemistry of Materials, Vol. 15, Issue 7 https://doi.org/10.1021/cm020198h	journal	March 2003
Polymer–inorganic solid–electrolyte interphase for stable lithium metal batteries under lean electrolyte conditions Gao, Yue; Yan, Zhifei; Gray, Jennifer L. Nature Materials, Vol. 18, Issue 4 https://doi.org/10.1038/s41563-019-0305-8	journal	March 2019
Cluster analysis of soft X-ray spectromicroscopy data Lerotic, M.; Jacobsen, C.; Schäfer, T. Ultramicroscopy, Vol. 100, Issue 1-2 https://doi.org/10.1016/j.ultramic.2004.01.008	journal	July 2004
ATHENA , ARTEMIS , HEPHAESTUS : data analysis for X-ray absorption spectroscopy using IFEFFIT Ravel, B.; Newville, M. Journal of Synchrotron Radiation, Vol. 12, Issue 4 https://doi.org/10.1107/S0909049505012719	journal	June 2005
The OPLS [optimized potentials for liquid simulations] potential functions for proteins, energy minimizations for crystals of cyclic peptides and crambin Jorgensen, William L.; Tirado-Rives, Julian Journal of the American Chemical Society, Vol. 110, Issue 6 https://doi.org/10.1021/ja00214a001	journal	March 1988
Development and Testing of the OPLS All-Atom Force Field on Conformational Energetics and Properties of Organic Liquids Jorgensen, William L.; Maxwell, David S.; Tirado-Rives, Julian Journal of the American Chemical Society, Vol. 118, Issue 45 https://doi.org/10.1021/ja9621760	journal	January 1996
GROMACS: High performance molecular simulations through multi-level parallelism from laptops to supercomputers Abraham, Mark James; Murtola, Teemu; Schulz, Roland SoftwareX, Vol. 1-2 https://doi.org/10.1016/j.softx.2015.06.001	journal	September 2015
GROMACS 4.5: a high-throughput and highly parallel open source molecular simulation toolkit Pronk, Sander; Páll, Szilárd; Schulz, Roland Bioinformatics, Vol. 29, Issue 7 https://doi.org/10.1093/bioinformatics/btt055	journal	February 2013
GROMACS 4: Algorithms for Highly Efficient, Load-Balanced, and Scalable Molecular Simulation Hess, Berk; Kutzner, Carsten; van der Spoel, David Journal of Chemical Theory and Computation, Vol. 4, Issue 3 https://doi.org/10.1021/ct700301q	journal	February 2008
GROMACS: Fast, flexible, and free Van Der Spoel, David; Lindahl, Erik; Hess, Berk Journal of Computational Chemistry, Vol. 26, Issue 16 https://doi.org/10.1002/jcc.20291	journal	January 2005
GROMACS: A message-passing parallel molecular dynamics implementation Berendsen, H. J. C.; van der Spoel, D.; van Drunen, R. Computer Physics Communications, Vol. 91, Issue 1-3 https://doi.org/10.1016/0010-4655(95)00042-E	journal	September 1995
Improved Peptide and Protein Torsional Energetics with the OPLS-AA Force Field Robertson, Michael J.; Tirado-Rives, Julian; Jorgensen, William L. Journal of Chemical Theory and Computation, Vol. 11, Issue 7 https://doi.org/10.1021/acs.jctc.5b00356	journal	June 2015
LigParGen web server: an automatic OPLS-AA parameter generator for organic ligands Dodda, Leela S.; Cabeza de Vaca, Israel; Tirado-Rives, Julian Nucleic Acids Research, Vol. 45, Issue W1 https://doi.org/10.1093/nar/gkx312	journal	April 2017
An approach to computing electrostatic charges for molecules Singh, U. Chandra; Kollman, Peter A. Journal of Computational Chemistry, Vol. 5, Issue 2 https://doi.org/10.1002/jcc.540050204	journal	April 1984
Characterization of end groups and branching structures in copolymers of vinylidene fluoride with hexafluoropropylene using multidimensional NMR spectroscopy Twum, Eric B.; McCord, Elizabeth F.; Lyons, Donald F. European Polymer Journal, Vol. 51 https://doi.org/10.1016/j.eurpolymj.2013.12.006	journal	February 2014
Kinetics of the Emulsion Polymerization of Vinylidene Fluoride and Hexafluoropropylene Apostolo, Marco; Arcella, Vincenzo; Storti, Giuseppe Macromolecules, Vol. 32, Issue 4 https://doi.org/10.1021/ma980683r	journal	January 1999
Fluoroelastomers: synthesis, properties and applications Améduri, B.; Boutevin, B.; Kostov, G. Progress in Polymer Science, Vol. 26, Issue 1 https://doi.org/10.1016/S0079-6700(00)00044-7	journal	February 2001
Characterization of Backbone Structures in Poly(vinylidene fluoride-co-hexafluoropropylene) Copolymers by Multidimensional ¹⁹F NMR Spectroscopy Twum, Eric B.; McCord, Elizabeth F.; Fox, Peter A. Macromolecules, Vol. 46, Issue 12 https://doi.org/10.1021/ma400683w	journal	June 2013
Modeling and Simulations of Polymers: A Roadmap Gartner, Thomas E.; Jayaraman, Arthi Macromolecules, Vol. 52, Issue 3 https://doi.org/10.1021/acs.macromol.8b01836	journal	January 2019
Quiet high-resolution computer models of a plasma Hockney, R. W.; Goel, S. P.; Eastwood, J. W. Journal of Computational Physics, Vol. 14, Issue 2 https://doi.org/10.1016/0021-9991(74)90010-2	journal	February 1974
LINCS: A linear constraint solver for molecular simulations Hess, Berk; Bekker, Henk; Berendsen, Herman J. C. Journal of Computational Chemistry, Vol. 18, Issue 12 https://doi.org/10.1002/(SICI)1096-987X(199709)18:12<1463::AID-JCC4>3.0.CO;2-H	journal	September 1997
Particle mesh Ewald: An N ⋅log( N ) method for Ewald sums in large systems Darden, Tom; York, Darrin; Pedersen, Lee The Journal of Chemical Physics, Vol. 98, Issue 12 https://doi.org/10.1063/1.464397	journal	June 1993
Molecular dynamics with coupling to an external bath Berendsen, H. J. C.; Postma, J. P. M.; van Gunsteren, W. F. The Journal of Chemical Physics, Vol. 81, Issue 8 https://doi.org/10.1063/1.448118	journal	October 1984
Canonical sampling through velocity rescaling Bussi, Giovanni; Donadio, Davide; Parrinello, Michele The Journal of Chemical Physics, Vol. 126, Issue 1 https://doi.org/10.1063/1.2408420	journal	January 2007
Polymorphic transitions in single crystals: A new molecular dynamics method Parrinello, M.; Rahman, A. Journal of Applied Physics, Vol. 52, Issue 12 https://doi.org/10.1063/1.328693	journal	December 1981
TRAVIS—A free analyzer for trajectories from molecular simulation Brehm, M.; Thomas, M.; Gehrke, S. The Journal of Chemical Physics, Vol. 152, Issue 16 https://doi.org/10.1063/5.0005078	journal	April 2020
GFN2-xTB—An Accurate and Broadly Parametrized Self-Consistent Tight-Binding Quantum Chemical Method with Multipole Electrostatics and Density-Dependent Dispersion Contributions Bannwarth, Christoph; Ehlert, Sebastian; Grimme, Stefan Journal of Chemical Theory and Computation, Vol. 15, Issue 3 https://doi.org/10.1021/acs.jctc.8b01176	journal	January 2019
The ORCA program system: The ORCA program system Neese, Frank Wiley Interdisciplinary Reviews: Computational Molecular Science, Vol. 2, Issue 1 https://doi.org/10.1002/wcms.81	journal	June 2011
A combined DFT and restricted open-shell configuration interaction method including spin-orbit coupling: Application to transition metal L-edge X-ray absorption spectroscopy Roemelt, Michael; Maganas, Dimitrios; DeBeer, Serena The Journal of Chemical Physics, Vol. 138, Issue 20 https://doi.org/10.1063/1.4804607	journal	May 2013
First principles calculations of the structure and V L-edge X-ray absorption spectra of V2O5 using local pair natural orbital coupled cluster theory and spin–orbit coupled configuration interaction approaches Maganas, Dimitrios; Roemelt, Michael; Hävecker, Michael Physical Chemistry Chemical Physics, Vol. 15, Issue 19 https://doi.org/10.1039/c3cp50709b	journal	January 2013
Density‐functional thermochemistry. III. The role of exact exchange Becke, Axel D. The Journal of Chemical Physics, Vol. 98, Issue 7, p. 5648-5652 https://doi.org/10.1063/1.464913	journal	April 1993
Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density Lee, Chengteh; Yang, Weitao; Parr, Robert G. Physical Review B, Vol. 37, Issue 2 https://doi.org/10.1103/PhysRevB.37.785	journal	January 1988
Fully optimized contracted Gaussian basis sets for atoms Li to Kr Schäfer, Ansgar; Horn, Hans; Ahlrichs, Reinhart The Journal of Chemical Physics, Vol. 97, Issue 4 https://doi.org/10.1063/1.463096	journal	August 1992
Balanced basis sets of split valence, triple zeta valence and quadruple zeta valence quality for H to Rn: Design and assessment of accuracy Weigend, Florian; Ahlrichs, Reinhart Physical Chemistry Chemical Physics, Vol. 7, Issue 18, p. 3297-3305 https://doi.org/10.1039/b508541a	journal	January 2005
The impact of the resolution of the identity approximate integral method on modern ab initio algorithm development Kendall, Rick A.; Früchtl, Herbert A. Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta), Vol. 97, Issue 1-4 https://doi.org/10.1007/s002140050249	journal	October 1997
All-Electron Scalar Relativistic Basis Sets for Third-Row Transition Metal Atoms Pantazis, Dimitrios A.; Chen, Xian-Yang; Landis, Clark R. Journal of Chemical Theory and Computation, Vol. 4, Issue 6 https://doi.org/10.1021/ct800047t	journal	May 2008

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