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Volumn 2, Issue 3, 2014, Pages

Formation of Large Polysulfide Complexes during the Lithium-Sulfur Battery Discharge

Author keywords

[No Author keywords available]

Indexed keywords

BINARY ALLOYS; CALCULATIONS; CATHODES; COMPLEX NETWORKS; ELECTROLYTES; LITHIUM COMPOUNDS; LITHIUM SULFUR BATTERIES; LITHIUM-ION BATTERIES; MOLECULAR DYNAMICS; OXYGEN; POLYSULFIDES; TIN ALLOYS; TRANSITION METAL OXIDES; TRANSITION METALS;

EID: 84925759724     PISSN: None     EISSN: 23317019     Source Type: Journal    
DOI: 10.1103/PhysRevApplied.2.034004     Document Type: Article
Times cited : (122)

References (53)
  • 1
    • 0035890440 scopus 로고    scopus 로고
    • Issues and challenges facing rechargeable lithium batteries
    • J.-M. Tarascon and Michel Armand, Issues and challenges facing rechargeable lithium batteries, Nature (London) 414, 359 (2001). NATUAS 0028-0836 10.1038/35104644
    • (2001) Nature (London) , vol.414 , pp. 359
    • Tarascon, J.-M.1    Armand, M.2
  • 2
    • 80052186975 scopus 로고    scopus 로고
    • Lithium-ion batteries. A look into the future
    • Bruno Scrosati, Jusef Hassoun, and Yang-Kook Sun, Lithium-ion batteries. A look into the future, Energy Environ. Sci. 4, 3287 (2011). EESNBY 1754-5692 10.1039/c1ee01388b
    • (2011) Energy Environ. Sci. , vol.4 , pp. 3287
    • Scrosati, B.1    Hassoun, J.2    Sun, Y.3
  • 3
    • 83655183076 scopus 로고    scopus 로고
    • (Equation presented) and Li-S batteries with high energy storage
    • P. G. Bruce, S. A. Freunberger, L. J. Hardwick, and J.-M. Tarascon, (Equation presented) and Li-S batteries with high energy storage, Nat. Mater. 11, 19 (2012). NMAACR 1476-1122 10.1038/nmat3191
    • (2012) Nat. Mater. , vol.11 , pp. 19
    • Bruce, P.G.1    Freunberger, S.A.2    Hardwick, L.J.3    Tarascon, J.-M.4
  • 4
    • 21244451609 scopus 로고    scopus 로고
    • Advances in manganese-oxide composite electrodes for lithium-ion batteries
    • Michael M. Thackeray, Christopher S. Johnson, John T. Vaughey, N. Li, and Stephen A. Hackney, Advances in manganese-oxide composite electrodes for lithium-ion batteries, J. Mater. Chem. 15, 2257 (2005). JMACEP 0959-9428 10.1039/b417616m
    • (2005) J. Mater. Chem. , vol.15 , pp. 2257
    • Thackeray, M.M.1    Johnson, C.S.2    Vaughey, J.T.3    Li, N.4    Hackney, S.A.5
  • 5
    • 84864265185 scopus 로고    scopus 로고
    • Simultaneous enhancement of electronic and (Equation presented) ion conductivity in (Equation presented)
    • Jaekwang Lee, Stephen J. Pennycook, and Sokrates T. Pantelides, Simultaneous enhancement of electronic and (Equation presented) ion conductivity in (Equation presented), Appl. Phys. Lett. 101, 033901 (2012). APPLAB 0003-6951 10.1063/1.4737212
    • (2012) Appl. Phys. Lett. , vol.101 , pp. 033901
    • Lee, J.1    Pennycook, S.J.2    Pantelides, S.T.3
  • 6
    • 84860375002 scopus 로고    scopus 로고
    • Vacancy-driven anisotropic defect distribution in the battery-cathode material (Equation presented)
    • Jaekwang Lee, Wu Zhou, Juan C. Idrobo, Stephen J. Pennycook, and Sokrates T. Pantelides, Vacancy-driven anisotropic defect distribution in the battery-cathode material (Equation presented), Phys. Rev. Lett. 107, 085507 (2011). PRLTAO 0031-9007 10.1103/PhysRevLett.107.085507
    • (2011) Phys. Rev. Lett. , vol.107 , pp. 085507
    • Lee, J.1    Zhou, W.2    Idrobo, J.C.3    Pennycook, S.J.4    Pantelides, S.T.5
  • 7
    • 84873825623 scopus 로고    scopus 로고
    • The Li-ion rechargeable battery: A perspective
    • John B. Goodenough and Kyu-Sung Park, The Li-ion rechargeable battery: A perspective, J. Am. Chem. Soc. 135, 1167 (2013). JACSAT 0002-7863 10.1021/ja3091438
    • (2013) J. Am. Chem. Soc. , vol.135 , pp. 1167
    • Goodenough, J.B.1    Park, K.2
  • 8
    • 79751525327 scopus 로고    scopus 로고
    • Safe and fast-charging Li-ion battery with long shelf life for power applications
    • K. Zaghib, M. Dontigny, A. Guerfi, P. Charest, I. Rodrigues, A. Mauger, and C. M. Julien, Safe and fast-charging Li-ion battery with long shelf life for power applications, J. Power Sources 196, 3949 (2011). JPSODZ 0378-7753 10.1016/j.jpowsour.2010.11.093
    • (2011) J. Power Sources , vol.196 , pp. 3949
    • Zaghib, K.1    Dontigny, M.2    Guerfi, A.3    Charest, P.4    Rodrigues, I.5    Mauger, A.6    Julien, C.M.7
  • 9
    • 84872731191 scopus 로고    scopus 로고
    • Liquid electrolyte lithium/sulfur battery: Fundamental chemistry, problems, and solutions
    • S. S. Zhang, Liquid electrolyte lithium/sulfur battery: Fundamental chemistry, problems, and solutions, J. Power Sources 231, 153 (2013). JPSODZ 0378-7753 10.1016/j.jpowsour.2012.12.102
    • (2013) J. Power Sources , vol.231 , pp. 153
    • Zhang, S.S.1
  • 10
    • 0024014181 scopus 로고
    • Lithium sulfur battery oxidation/reduction mechanisms of polysulfides in THF solutions
    • H. Yamin, A. Gorenshtein, J. Penciner, Y. Sternberg, and E. Peled, Lithium sulfur battery oxidation/reduction mechanisms of polysulfides in THF solutions, J. Electrochem. Soc. 135, 1045 (1988). JESOAN 0013-4651 10.1149/1.2095868
    • (1988) J. Electrochem. Soc. , vol.135 , pp. 1045
    • Yamin, H.1    Gorenshtein, A.2    Penciner, J.3    Sternberg, Y.4    Peled, E.5
  • 11
    • 10944234873 scopus 로고    scopus 로고
    • Polysulfide shuttle study in the (Equation presented) battery system
    • Yuriy V. Mikhaylik and James R. Akridge, Polysulfide shuttle study in the (Equation presented) battery system, J. Electrochem. Soc. 151, A1969 (2004). JESOAN 0013-4651 10.1149/1.1806394
    • (2004) J. Electrochem. Soc. , vol.151 , pp. A1969
    • Mikhaylik, Y.V.1    Akridge, J.R.2
  • 12
    • 84860426619 scopus 로고    scopus 로고
    • Lithium/sulfur cell discharge mechanism: An original approach for intermediate species identification
    • Céline Barchasz, Florian Molton, Carole Duboc, Jean-Claude Leprêtre, Sébastien Patoux, and Fannie Alloin, Lithium/sulfur cell discharge mechanism: An original approach for intermediate species identification, Anal. Chem. 84, 3973 (2012). ANCHAM 0003-2700 10.1021/ac2032244
    • (2012) Anal. Chem. , vol.84 , pp. 3973
    • Barchasz, C.1    Molton, F.2    Duboc, C.3    Leprêtre, J.4    Patoux, S.5    Alloin, F.6
  • 14
    • 78049377906 scopus 로고    scopus 로고
    • Advances in Li-S batteries
    • X. L. Ji and L. F. Nazar, Advances in Li-S batteries, J. Mater. Chem. 20, 9821 (2010). JMACEP 0959-9428 10.1039/b925751a
    • (2010) J. Mater. Chem. , vol.20 , pp. 9821
    • Ji, X.L.1    Nazar, L.F.2
  • 16
    • 67349275043 scopus 로고    scopus 로고
    • A highly ordered nanostructured carbon-sulphur cathode for lithium-sulphur batteries
    • Xiulei Ji, Kyu Tae Lee, and Linda F Nazar, A highly ordered nanostructured carbon-sulphur cathode for lithium-sulphur batteries, Nat. Mater. 8, 500 (2009). NMAACR 1476-1122 10.1038/nmat2460
    • (2009) Nat. Mater. , vol.8 , pp. 500
    • Ji, X.1    Tae Lee, K.2    Nazar, L.F.3
  • 17
    • 70350214284 scopus 로고    scopus 로고
    • Hierarchically structured sulfur/carbon nanocomposite material for high-energy lithium battery
    • Chengdu Liang, Nancy J. Dudney, and Jane Y. Howe, Hierarchically structured sulfur/carbon nanocomposite material for high-energy lithium battery, Chem. Mater. 21, 4724 (2009). CMATEX 0897-4756 10.1021/cm902050j
    • (2009) Chem. Mater. , vol.21 , pp. 4724
    • Liang, C.1    Dudney, N.J.2    Howe, J.Y.3
  • 18
    • 79957554842 scopus 로고    scopus 로고
    • Stabilizing lithium-sulphur cathodes using polysulphide reservoirs
    • Xiulei Ji, Scott Evers, Robert Black, and Linda F. Nazar, Stabilizing lithium-sulphur cathodes using polysulphide reservoirs, Nat. Commun. 2, 325 (2011). NCAOBW 2041-1723 10.1038/ncomms1293
    • (2011) Nat. Commun. , vol.2 , pp. 325
    • Ji, X.1    Evers, S.2    Black, R.3    Nazar, L.F.4
  • 19
    • 84886012072 scopus 로고    scopus 로고
    • Sulphur-(Equation presented) yolk-shell nanoarchitecture with internal void space for long-cycle lithium-sulphur batteries
    • Zhi Wei Seh, Weiyang Li, Judy J. Cha, Guangyuan Zheng, Yuan Yang, Matthew T. McDowell, Po-Chun Hsu, and Yi Cui, Sulphur-(Equation presented) yolk-shell nanoarchitecture with internal void space for long-cycle lithium-sulphur batteries, Nat. Commun. 4, 1331 (2013). NCAOBW 2041-1723 10.1038/ncomms2327
    • (2013) Nat. Commun. , vol.4 , pp. 1331
    • Wei Seh, Z.1    Li, W.2    Cha, J.J.3    Zheng, G.4    Yang, Y.5    McDowell, M.T.6    Hsu, P.7    Cui, Y.8
  • 20
    • 78649348254 scopus 로고    scopus 로고
    • Enhancement of long stability of sulfur cathode by encapsulating sulfur into micropores of carbon spheres
    • B. Zhang, X. Qin, G. R. Li, and X. P. Gao, Enhancement of long stability of sulfur cathode by encapsulating sulfur into micropores of carbon spheres, Energy Environ. Sci. 3, 1531 (2010). EESNBY 1754-5692 10.1039/c002639e
    • (2010) Energy Environ. Sci. , vol.3 , pp. 1531
    • Zhang, B.1    Qin, X.2    Li, G.R.3    Gao, X.P.4
  • 21
    • 81855177332 scopus 로고    scopus 로고
    • Improving the performance of lithium-sulfur batteries by conductive polymer coating
    • Yuan Yang, Guihua Yu, Judy J. Cha, Hui Wu, Michael Vosgueritchian, Yan Yao, Zhenan Bao, and Yi Cui, Improving the performance of lithium-sulfur batteries by conductive polymer coating, ACS Nano 5, 9187 (2011). ANCAC3 1936-0851 10.1021/nn203436j
    • (2011) ACS Nano , vol.5 , pp. 9187
    • Yang, Y.1    Yu, G.2    Cha, J.J.3    Wu, H.4    Vosgueritchian, M.5    Yao, Y.6    Bao, Z.7    Cui, Y.8
  • 22
    • 80054036547 scopus 로고    scopus 로고
    • Sulfur-impregnated disordered carbon nanotubes cathode for lithium-sulfur batteries
    • Juchen Guo, Yunhua Xu, and Chunsheng Wang, Sulfur-impregnated disordered carbon nanotubes cathode for lithium-sulfur batteries, Nano Lett. 11, 4288 (2011). NALEFD 1530-6984 10.1021/nl202297p
    • (2011) Nano Lett. , vol.11 , pp. 4288
    • Guo, J.1    Xu, Y.2    Wang, C.3
  • 23
    • 79959209197 scopus 로고    scopus 로고
    • Porous hollow carbon@sulfur composites for high-power lithium-sulfur batteries
    • N. Jayaprakash, J. Shen, Surya S. Moganty, A. Corona, and Lynden A. Archer, Porous hollow carbon@sulfur composites for high-power lithium-sulfur batteries, Angew. Chem. 123, 6026 (2011). 10.1002/ange.201100637 ANCEAD 0044-8249
    • (2011) Angew. Chem. , vol.123 , pp. 6026
    • Jayaprakash, N.1    Shen, J.2    Moganty, S.S.3    Corona, A.4    Archer, L.A.5
  • 24
    • 84869469638 scopus 로고    scopus 로고
    • Smaller sulfur molecules promise better lithium-sulfur batteries
    • Sen Xin, Lin Gu, Na-Hong Zhao, Ya-Xia Yin, Long-Jie Zhou, Yu-Guo Guo, and Li-Jun Wan, Smaller sulfur molecules promise better lithium-sulfur batteries, J. Am. Chem. Soc. 134, 18510 (2012). JACSAT 0002-7863 10.1021/ja308170k
    • (2012) J. Am. Chem. Soc. , vol.134 , pp. 18510
    • Xin, S.1    Gu, L.2    Zhao, N.3    Yin, Y.4    Zhou, L.5    Guo, Y.6    Wan, L.7
  • 25
    • 84859545734 scopus 로고    scopus 로고
    • Spherical ordered mesoporous carbon nanoparticles with high porosity for lithium-sulfur batteries
    • Jörg Schuster, Guang He, Benjamin Mandlmeier, Taeeun Yim, Kyu Tae Lee, Thomas Bein, and Linda F. Nazar, Spherical ordered mesoporous carbon nanoparticles with high porosity for lithium-sulfur batteries, Angew. Chem., Int. Ed. 51, 3591 (2012). ACIEF5 1433-7851 10.1002/anie.201107817
    • (2012) Angew. Chem., Int. Ed. , vol.51 , pp. 3591
    • Schuster, J.1    He, G.2    Mandlmeier, B.3    Yim, T.4    Tae Lee, K.5    Bein, T.6    Nazar, L.F.7
  • 26
    • 84890460577 scopus 로고    scopus 로고
    • Ionic shield for polysulfides towards highly-stable lithium-sulfur batteries
    • Jia-Qi Huang, Qiang Zhang, Hong-Jie Peng, Xin-Yan Liu, Wei-Zhong Qian, and Fei Wei, Ionic shield for polysulfides towards highly-stable lithium-sulfur batteries, Energy Environ. Sci. 7, 347 (2014). EESNBY 1754-5692 10.1039/c3ee42223b
    • (2014) Energy Environ. Sci. , vol.7 , pp. 347
    • Huang, J.1    Zhang, Q.2    Peng, H.3    Liu, X.4    Qian, W.5    Wei, F.6
  • 27
    • 67650595207 scopus 로고    scopus 로고
    • On the surface chemical aspects of very high energy density, rechargeable Li-sulfur batteries
    • Doron Aurbach, Elad Pollak, Ran Elazari, Gregory Salitra, C. Scordilis Kelley, and John Affinito, On the surface chemical aspects of very high energy density, rechargeable Li-sulfur batteries, J. Electrochem. Soc. 156, A694 (2009). JESOAN 0013-4651 10.1149/1.3148721
    • (2009) J. Electrochem. Soc. , vol.156 , pp. A694
    • Aurbach, D.1    Pollak, E.2    Elazari, R.3    Salitra, G.4    Scordilis Kelley, C.5    Affinito, J.6
  • 28
    • 77953529924 scopus 로고    scopus 로고
    • A high-performance polymer tin sulfur lithium ion battery
    • Jusef Hassoun and Bruno Scrosati, A high-performance polymer tin sulfur lithium ion battery, Angew. Chem., Int. Ed. 49, 2371 (2010). ACIEF5 1433-7851 10.1002/anie.200907324
    • (2010) Angew. Chem., Int. Ed. , vol.49 , pp. 2371
    • Hassoun, J.1    Scrosati, B.2
  • 29
    • 84874643117 scopus 로고    scopus 로고
    • A new class of solvent-in-salt electrolyte for high-energy rechargeable metallic lithium batteries
    • L. M. Suo, Y.-S. Hu, H. Li, M. Armand, and L. Q. Chen, A new class of solvent-in-salt electrolyte for high-energy rechargeable metallic lithium batteries, Nat. Commun. 4, 1481 (2013). NCAOBW 2041-1723 10.1038/ncomms2513
    • (2013) Nat. Commun. , vol.4 , pp. 1481
    • Suo, L.M.1    Hu, Y.-S.2    Li, H.3    Armand, M.4    Chen, L.Q.5
  • 30
    • 39149107789 scopus 로고    scopus 로고
    • Sulfur-mesoporous carbon composites in conjunction with a novel ionic liquid electrolyte for lithium rechargeable batteries
    • J. Wang, S. Y. Chew, Z. W. Zhao, S. Ashraf, David Wexler, J. Chen, S. H. Ng, S. L. Chou, and H. K. Liu, Sulfur-mesoporous carbon composites in conjunction with a novel ionic liquid electrolyte for lithium rechargeable batteries, Carbon 46, 229 (2008). CRBNAH 0008-6223 10.1016/j.carbon.2007.11.007
    • (2008) Carbon , vol.46 , pp. 229
    • Wang, J.1    Chew, S.Y.2    Zhao, Z.W.3    Ashraf, S.4    Wexler, D.5    Chen, J.6    Ng, S.H.7    Chou, S.L.8    Liu, H.K.9
  • 31
    • 84933517253 scopus 로고    scopus 로고
    • A strategic approach to recharging lithium-sulphur batteries for long cycle life
    • Y.-S. Su, Y. Z. Fu, T. Cochell, and A. Manthiram, A strategic approach to recharging lithium-sulphur batteries for long cycle life, Nat. Commun. 4, 2985 (2013). NCAOBW 2041-1723 10.1038/ncomms3985
    • (2013) Nat. Commun. , vol.4 , pp. 2985
    • Su, Y.-S.1    Fu, Y.Z.2    Cochell, T.3    Manthiram, A.4
  • 32
    • 79958046348 scopus 로고    scopus 로고
    • Sulfur-graphene composite for rechargeable lithium batteries
    • Jia-Zhao Wang, Lin Lu, Mohammad Choucair, John A. Stride, Xun Xu, and Hua-Kun Liu, Sulfur-graphene composite for rechargeable lithium batteries, J. Power Sources 196, 7030 (2011). JPSODZ 0378-7753 10.1016/j.jpowsour.2010.09.106
    • (2011) J. Power Sources , vol.196 , pp. 7030
    • Wang, J.1    Lu, L.2    Choucair, M.3    Stride, J.A.4    Xu, X.5    Liu, H.6
  • 33
    • 79955990581 scopus 로고    scopus 로고
    • Sandwich-type functionalized graphene sheet-sulfur nanocomposite for rechargeable lithium batteries
    • Yuliang Cao, Xiaolin Li, Ilhan A. Aksay, John Lemmon, Zimin Nie, Zhenguo Yang, and Jun Liu, Sandwich-type functionalized graphene sheet-sulfur nanocomposite for rechargeable lithium batteries, Phys. Chem. Chem. Phys. 13, 7660 (2011). PPCPFQ 1463-9076 10.1039/c0cp02477e
    • (2011) Phys. Chem. Chem. Phys. , vol.13 , pp. 7660
    • Cao, Y.1    Li, X.2    Aksay, I.A.3    Lemmon, J.4    Nie, Z.5    Yang, Z.6    Liu, J.7
  • 34
    • 83055161614 scopus 로고    scopus 로고
    • Graphene oxide as a sulfur immobilizer in high performance lithium/sulfur cells
    • Liwen Ji, Mumin Rao, Haimei Zheng, Liang Zhang, Yuanchang Li, Wenhui Duan, Jinghua Guo, Elton J. Cairns, and Yuegang Zhang, Graphene oxide as a sulfur immobilizer in high performance lithium/sulfur cells, J. Am. Chem. Soc. 133, 18522 (2011). JACSAT 0002-7863 10.1021/ja206955k
    • (2011) J. Am. Chem. Soc. , vol.133 , pp. 18522
    • Ji, L.1    Rao, M.2    Zheng, H.3    Zhang, L.4    Li, Y.5    Duan, W.6    Guo, J.7    Cairns, E.J.8    Zhang, Y.9
  • 35
    • 79960237024 scopus 로고    scopus 로고
    • Graphene-wrapped sulfur particles as a rechargeable lithium-sulfur battery cathode material with high capacity and cycling stability
    • Hailiang Wang, Yuan Yang, Yongye Liang, Joshua Tucker Robinson, Yanguang Li, Ariel Jackson, Yi Cui, and Hongjie Dai, Graphene-wrapped sulfur particles as a rechargeable lithium-sulfur battery cathode material with high capacity and cycling stability, Nano Lett. 11, 2644 (2011). NALEFD 1530-6984 10.1021/nl200658a
    • (2011) Nano Lett. , vol.11 , pp. 2644
    • Wang, H.1    Yang, Y.2    Liang, Y.3    Tucker Robinson, J.4    Li, Y.5    Jackson, A.6    Cui, Y.7    Dai, H.8
  • 36
    • 84879673323 scopus 로고    scopus 로고
    • Fibrous hybrid of graphene and sulfur nanocrystals for high-performance lithium-sulfur batteries
    • Guangmin Zhou, Li-Chang Yin, Da-Wei Wang, Lu Li, Songfeng Pei, Ian Ross Gentle, Feng Li, and Hui-Ming Cheng, Fibrous hybrid of graphene and sulfur nanocrystals for high-performance lithium-sulfur batteries, ACS Nano 7, 5367 (2013). ANCAC3 1936-0851 10.1021/nn401228t
    • (2013) ACS Nano , vol.7 , pp. 5367
    • Zhou, G.1    Yin, L.2    Wang, D.3    Li, L.4    Pei, S.5    Ross Gentle, I.6    Li, F.7    Cheng, H.8
  • 37
    • 84955135059 scopus 로고    scopus 로고
    • Unstacked double-layer templated graphene for high-rate lithium-sulphur batteries
    • Meng-Qiang Zhao, Qiang Zhang, Jia-Qi Huang, Gui-Li Tian, Jing-Qi Nie, Hong-Jie Peng, and Fei Wei, Unstacked double-layer templated graphene for high-rate lithium-sulphur batteries, Nat. Commun. 5, 3410 (2014). NCAOBW 2041-1723 10.1038/ncomms4410
    • (2014) Nat. Commun. , vol.5 , pp. 3410
    • Zhao, M.1    Zhang, Q.2    Huang, J.3    Tian, G.4    Nie, J.5    Peng, H.6    Wei, F.7
  • 38
    • 84901981503 scopus 로고    scopus 로고
    • Towards a molecular understanding of energetics in Li-S batteries using non-aqueous electrolytes: A high-level quantum chemical study
    • Rajeev S. Assary, Larry A. Curtiss, and Jeffrey S. Moore, Towards a molecular understanding of energetics in Li-S batteries using non-aqueous electrolytes: A high-level quantum chemical study, J. Phys. Chem. C 118, 11545 (2014). JPCCCK 1932-7447 10.1021/jp5015466
    • (2014) J. Phys. Chem. C , vol.118 , pp. 11545
    • Assary, R.S.1    Curtiss, L.A.2    Moore, J.S.3
  • 39
    • 2442537377 scopus 로고    scopus 로고
    • Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set
    • Georg Kresse and Jürgen Furthmüller, Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set, Phys. Rev. B 54, 11169 (1996). PRBMDO 0163-1829 10.1103/PhysRevB.54.11169
    • (1996) Phys. Rev. B , vol.54 , pp. 11169
    • Kresse, G.1    Furthmüller, J.2
  • 40
    • 4243943295 scopus 로고    scopus 로고
    • Generalized gradient approximation made simple
    • John P. Perdew, Kieron Burke, and Matthias Ernzerhof, Generalized gradient approximation made simple, Phys. Rev. Lett. 77, 3865 (1996). PRLTAO 0031-9007 10.1103/PhysRevLett.77.3865
    • (1996) Phys. Rev. Lett. , vol.77 , pp. 3865
    • Perdew, J.P.1    Burke, K.2    Ernzerhof, M.3
  • 41
    • 25744460922 scopus 로고
    • Projector augmented-wave method
    • Peter E. Blöchl, Projector augmented-wave method, Phys. Rev. B 50, 17953 (1994). PRBMDO 0163-1829 10.1103/PhysRevB.50.17953
    • (1994) Phys. Rev. B , vol.50 , pp. 17953
    • Blöchl, P.E.1
  • 42
    • 0011236321 scopus 로고    scopus 로고
    • From ultrasoft pseudopotentials to the projector augmented-wave method
    • G. Kresse and D. Joubert, From ultrasoft pseudopotentials to the projector augmented-wave method, Phys. Rev. B 59, 1758 (1999). PRBMDO 0163-1829 10.1103/PhysRevB.59.1758
    • (1999) Phys. Rev. B , vol.59 , pp. 1758
    • Kresse, G.1    Joubert, D.2
  • 43
    • 0037799714 scopus 로고    scopus 로고
    • Hybrid functionals based on a screened coulomb potential
    • Jochen Heyd, Gustavo E. Scuseria, and Matthias Ernzerhof, Hybrid functionals based on a screened coulomb potential, J. Chem. Phys. 118, 8207 (2003). JCPSA6 0021-9606 10.1063/1.1564060
    • (2003) J. Chem. Phys. , vol.118 , pp. 8207
    • Heyd, J.1    Scuseria, G.E.2    Ernzerhof, M.3
  • 44
    • 84882706507 scopus 로고    scopus 로고
    • Charge transport in lithium peroxide: Relevance for rechargeable metal-air batteries
    • Maxwell D. Radin and Donald J. Siegel, Charge transport in lithium peroxide: Relevance for rechargeable metal-air batteries, Energy Environ. Sci. 6, 2370 (2013). EESNBY 1754-5692 10.1039/c3ee41632a
    • (2013) Energy Environ. Sci. , vol.6 , pp. 2370
    • Radin, M.D.1    Siegel, D.J.2
  • 45
    • 6244276933 scopus 로고
    • Elemental sulfur
    • B. Meyer, Elemental sulfur, Chem. Rev. 76, 367 (1976). CHREAY 0009-2665 10.1021/cr60301a003
    • (1976) Chem. Rev. , vol.76 , pp. 367
    • Meyer, B.1
  • 46
    • 84879858703 scopus 로고    scopus 로고
    • A quantum-chemical study on the discharge reaction mechanism of lithium-sulfur batteries
    • Lijiang Wang, Tianran Zhang, Siqi Yang, Fangyi Cheng, Jing Liang, and Jun Chen, A quantum-chemical study on the discharge reaction mechanism of lithium-sulfur batteries, J. Energy Chem. 2095-4956 22, 72 (2013). 10.1016/S2095-4956(13)60009-1
    • (2013) J. Energy Chem. , vol.22 , pp. 72
    • Wang, L.1    Zhang, T.2    Yang, S.3    Cheng, F.4    Liang, J.5    Chen, J.6
  • 47
    • 84859570852 scopus 로고    scopus 로고
    • In operando x-ray diffraction and transmission x-ray microscopy of lithium sulfur batteries
    • Johanna Nelson, Sumohan Misra, Yuan Yang, Ariel Jackson, Yijin Liu, Hailiang Wang, Hongjie Dai, Joy C. Andrews, Yi Cui, and Michael F. Toney, In operando x-ray diffraction and transmission x-ray microscopy of lithium sulfur batteries, J. Am. Chem. Soc. 134, 6337 (2012). JACSAT 0002-7863 10.1021/ja2121926
    • (2012) J. Am. Chem. Soc. , vol.134 , pp. 6337
    • Nelson, J.1    Misra, S.2    Yang, Y.3    Jackson, A.4    Liu, Y.5    Wang, H.6    Dai, H.7    Andrews, J.C.8    Cui, Y.9    Toney, M.F.10
  • 48
    • 84871603808 scopus 로고    scopus 로고
    • Electrochemical properties of ether-based electrolytes for lithium/sulfur rechargeable batteries
    • Céline Barchasz, Jean-Claude Leprêtre, Sébastien Patoux, and Fannie Alloin, Electrochemical properties of ether-based electrolytes for lithium/sulfur rechargeable batteries, Electrochim. Acta 89, 737 (2013). ELCAAV 0013-4686 10.1016/j.electacta.2012.11.001
    • (2013) Electrochim. Acta , vol.89 , pp. 737
    • Barchasz, C.1    Leprêtre, J.2    Patoux, S.3    Alloin, F.4
  • 49
    • 0036821028 scopus 로고    scopus 로고
    • The consequences of translational and rotational entropy lost by small molecules on binding to proteins
    • Christopher W. Murray and Marcel L. Verdonk, The consequences of translational and rotational entropy lost by small molecules on binding to proteins, J. Comput.-Aided Mol. Des. 16, 741 (2002). JCADEQ 0920-654X 10.1023/A:1022446720849
    • (2002) J. Comput.-Aided Mol. Des. , vol.16 , pp. 741
    • Murray, C.W.1    Verdonk, M.L.2
  • 50
    • 66349120487 scopus 로고    scopus 로고
    • Universal solvation model based on solute electron density and on a continuum model of the solvent defined by the bulk dielectric constant and atomic surface tensions
    • Aleksandr V. Marenich, Christopher J. Cramer, and Donald G. Truhlar, Universal solvation model based on solute electron density and on a continuum model of the solvent defined by the bulk dielectric constant and atomic surface tensions, J. Phys. Chem. B 113, 6378 (2009). JPCBFK 1520-6106 10.1021/jp810292n
    • (2009) J. Phys. Chem. B , vol.113 , pp. 6378
    • Marenich, A.V.1    Cramer, C.J.2    Truhlar, D.G.3
  • 51
    • 84884815607 scopus 로고    scopus 로고
    • Enhanced chemical reactions of oxygen at grain boundaries in polycrystalline graphene
    • Bin Wang, Yevgeniy S. Puzyrev, and Sokrates T. Pantelides, Enhanced chemical reactions of oxygen at grain boundaries in polycrystalline graphene, Polyhedron 64, 158 (2013). PLYHDE 0277-5387 10.1016/j.poly.2013.03.032
    • (2013) Polyhedron , vol.64 , pp. 158
    • Wang, B.1    Puzyrev, Y.S.2    Pantelides, S.T.3
  • 53
    • 84899722454 scopus 로고    scopus 로고
    • Role of surface structure on Li-ion energy storage capacity of two-dimensional transition-metal carbides
    • Yu Xie, Michael Naguib, Vadym N. Mochalin, Michel W. Barsoum, Yury Gogotsi, Xiqian Yu, Kyung-Wan Nam, Xiao-Qing Yang, Alexander I. Kolesnikov, and Paul R. C. Kent, Role of surface structure on Li-ion energy storage capacity of two-dimensional transition-metal carbides, J. Am. Chem. Soc. 136, 6385 (2014). JACSAT 0002-7863 10.1021/ja501520b
    • (2014) J. Am. Chem. Soc. , vol.136 , pp. 6385
    • Xie, Y.1    Naguib, M.2    Mochalin, V.N.3    Barsoum, M.W.4    Gogotsi, Y.5    Yu, X.6    Nam, K.7    Yang, X.8    Kolesnikov, A.I.9    Kent, C.P.R.10


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