메뉴 건너뛰기




Volumn 119, Issue 27, 2015, Pages 14843-14850

A Comparative First-Principles Study on Sodiation of Silicon, Germanium, and Tin for Sodium-Ion Batteries

Author keywords

[No Author keywords available]

Indexed keywords

ALLOYS; ANODES; CALCULATIONS; DENSITY FUNCTIONAL THEORY; ELECTRIC BATTERIES; GERMANIUM; IONS; LITHIUM ALLOYS; METAL IONS; TIN; TIN ALLOYS;

EID: 84936884449     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/acs.jpcc.5b01099     Document Type: Article
Times cited : (107)

References (42)
  • 1
    • 0035976463 scopus 로고    scopus 로고
    • Lithium Ion Secondary Batteries; Past 10 Years and The Future
    • Nishi, Y. Lithium Ion Secondary Batteries; Past 10 Years and The Future J. Power Sources 2001, 100, 101-106
    • (2001) J. Power Sources , vol.100 , pp. 101-106
    • Nishi, Y.1
  • 2
    • 0035890440 scopus 로고    scopus 로고
    • Issues and Challenges Facing Rechargeable Lithium Batteries
    • Tarascon, J.-M.; Armand, M. Issues and Challenges Facing Rechargeable Lithium Batteries Nature 2001, 414, 359-367
    • (2001) Nature , vol.414 , pp. 359-367
    • Tarascon, J.-M.1    Armand, M.2
  • 5
    • 0021351909 scopus 로고
    • Alteration of the Oceanic Crust: Implications for Geochemical Cycles of Lithium and Boron
    • Seyfried, W. E., Jr.; Janecky, D. R.; Mottl, M. J. Alteration of the Oceanic Crust: Implications for Geochemical Cycles of Lithium and Boron Geochim. Cosmochim. Acta 1984, 48, 557-569
    • (1984) Geochim. Cosmochim. Acta , vol.48 , pp. 557-569
    • Seyfried, W.E.1    Janecky, D.R.2    Mottl, M.J.3
  • 6
    • 70349814431 scopus 로고    scopus 로고
    • Using the Cumulative Availability Curve to Assess the Threat of Mineral Depletion: the Case of Lithium
    • Yaksic, A.; Tilton, J. E. Using the Cumulative Availability Curve to Assess the Threat of Mineral Depletion: the Case of Lithium Resour. Policy 2009, 34, 185-194
    • (2009) Resour. Policy , vol.34 , pp. 185-194
    • Yaksic, A.1    Tilton, J.E.2
  • 7
    • 84867297718 scopus 로고    scopus 로고
    • Electrode Materials for Rechargeable Sodium-Ion Batteries: Potential Alternatives to Current Lithium-ion Batteries
    • Kim, S.-W.; Seo, D.-H.; Ma, X.; Ceder, G.; Kang, K. Electrode Materials for Rechargeable Sodium-Ion Batteries: Potential Alternatives to Current Lithium-ion Batteries Adv. Energy Mater. 2012, 2, 710-721
    • (2012) Adv. Energy Mater. , vol.2 , pp. 710-721
    • Kim, S.-W.1    Seo, D.-H.2    Ma, X.3    Ceder, G.4    Kang, K.5
  • 8
    • 0009800208 scopus 로고    scopus 로고
    • The Mechanisms of Lithium and Sodium Insertion in Carbon Materials
    • Stevens, D. A.; Dahn, J. R. The Mechanisms of Lithium and Sodium Insertion in Carbon Materials J. Electrochem. Soc. 2001, 148, A803-A811
    • (2001) J. Electrochem. Soc. , vol.148 , pp. A803-A811
    • Stevens, D.A.1    Dahn, J.R.2
  • 9
    • 79960898109 scopus 로고    scopus 로고
    • Challenges for Na-Ion Negative Electrodes
    • Chevrier, V. L.; Ceder, G. Challenges for Na-Ion Negative Electrodes J. Electrochem. Soc. 2011, 158, A1011-A1014
    • (2011) J. Electrochem. Soc. , vol.158 , pp. A1011-A1014
    • Chevrier, V.L.1    Ceder, G.2
  • 10
    • 0024068597 scopus 로고
    • Electrochemical Intercalation of Sodium in Graphite
    • Ge, P. Electrochemical Intercalation of Sodium in Graphite Solid State Ionics. 1988, 28-30, 1172-1175
    • (1988) Solid State Ionics. , vol.2830 , pp. 1172-1175
    • Ge, P.1
  • 11
    • 84879990082 scopus 로고    scopus 로고
    • Intrinsic Thermodynamic and Kinetic Properties of Sb Electrodes for Li-Ion and Na-Ion Batteries: Experiment and Theory
    • Baggetto, L.; Ganesh, P.; Sun, C.-N.; Meisner, R. A.; Zawodzinski, T. A.; Veith, G. M. Intrinsic Thermodynamic and Kinetic Properties of Sb Electrodes for Li-Ion and Na-Ion Batteries: Experiment and Theory J. Mater. Chem. A 2013, 1, 7985-7994
    • (2013) J. Mater. Chem. A , vol.1 , pp. 7985-7994
    • Baggetto, L.1    Ganesh, P.2    Sun, C.-N.3    Meisner, R.A.4    Zawodzinski, T.A.5    Veith, G.M.6
  • 12
    • 84871591420 scopus 로고    scopus 로고
    • Better Cycling Performances of Bulk Sb in Na-Ion Batteries Compared to Li-Ion Systems: An Unexpected Electrochemical Mechanism
    • Darwiche, A.; Marino, C.; Sougrati, M. T.; Fraisse, B.; Stievano, L.; Monconduit, L. Better Cycling Performances of Bulk Sb in Na-Ion Batteries Compared to Li-Ion Systems: An Unexpected Electrochemical Mechanism J. Am. Chem. Soc. 2012, 134, 20805-20811
    • (2012) J. Am. Chem. Soc. , vol.134 , pp. 20805-20811
    • Darwiche, A.1    Marino, C.2    Sougrati, M.T.3    Fraisse, B.4    Stievano, L.5    Monconduit, L.6
  • 13
    • 84863424112 scopus 로고    scopus 로고
    • Charge-Discharge Behavior of Tin Negative Electrode for A Sodium Secondary Battery Using Intermediate Temperature Ionic Liquid Sodium Bis(fluorosulfonyl)amide-Potassium Bis(fluorosulfonyl)amide
    • Yamamoto, T.; Nohira, T.; Hagiwara, R.; Fukunaga, A.; Sakai, S.; Nitta, K.; Inazawa, S. Charge-Discharge Behavior of Tin Negative Electrode for A Sodium Secondary Battery Using Intermediate Temperature Ionic Liquid Sodium Bis(fluorosulfonyl)amide-Potassium Bis(fluorosulfonyl)amide J. Power Sources 2012, 217, 479-484
    • (2012) J. Power Sources , vol.217 , pp. 479-484
    • Yamamoto, T.1    Nohira, T.2    Hagiwara, R.3    Fukunaga, A.4    Sakai, S.5    Nitta, K.6    Inazawa, S.7
  • 14
    • 84884269490 scopus 로고    scopus 로고
    • Sodium Insertion Into Tin Cobalt Carbon Active/Inactive Nanocomposite
    • Ellis, L. D.; Ferguson, P. P.; Obrovac, M. N. Sodium Insertion Into Tin Cobalt Carbon Active/Inactive Nanocomposite J. Electrochem. Soc. 2013, 160, A869-A872
    • (2013) J. Electrochem. Soc. , vol.160 , pp. A869-A872
    • Ellis, L.D.1    Ferguson, P.P.2    Obrovac, M.N.3
  • 15
    • 77954908012 scopus 로고    scopus 로고
    • Li-Alloy Based Anode Materials for Li Secondary Batteries
    • Park, C.-M.; Kim, J.-H.; Kim, H.; Sohn, H.-J. Li-Alloy Based Anode Materials for Li Secondary Batteries Chem. Soc. Rev. 2010, 39, 3115-3141
    • (2010) Chem. Soc. Rev. , vol.39 , pp. 3115-3141
    • Park, C.-M.1    Kim, J.-H.2    Kim, H.3    Sohn, H.-J.4
  • 16
    • 77956345139 scopus 로고    scopus 로고
    • A Review of the Electrochemical Performance of Alloy Anodes for Lithium-Ion Batteries
    • Zhang, W. J. A Review of the Electrochemical Performance of Alloy Anodes for Lithium-Ion Batteries J. Power Sources 2011, 196, 13-24
    • (2011) J. Power Sources , vol.196 , pp. 13-24
    • Zhang, W.J.1
  • 17
    • 33845622840 scopus 로고    scopus 로고
    • Nano- and Bulk-Silicon-Based Insertion Anodes for Lithium-Ion Secondary Cells
    • Kasavajjula, U.; Wang, C.; Appleby, A. J. Nano- and Bulk-Silicon-Based Insertion Anodes for Lithium-Ion Secondary Cells J. Power Sources 2007, 163, 1003-1039
    • (2007) J. Power Sources , vol.163 , pp. 1003-1039
    • Kasavajjula, U.1    Wang, C.2    Appleby, A.J.3
  • 18
    • 38749129063 scopus 로고    scopus 로고
    • High Capacity Li Ion Battery Anodes Using Ge Nanowires
    • Chen, C. K.; Zhang, X. F.; Cui, Y. High Capacity Li Ion Battery Anodes Using Ge Nanowires Nano Lett. 2008, 8, 307-309
    • (2008) Nano Lett. , vol.8 , pp. 307-309
    • Chen, C.K.1    Zhang, X.F.2    Cui, Y.3
  • 19
    • 0033337815 scopus 로고    scopus 로고
    • Electrochemical Lithiation of Tin and Tin-Based Intermetallics and Composites
    • Winter, M.; Besenhard, J. O. Electrochemical Lithiation of Tin and Tin-Based Intermetallics and Composites Electrochim. Acta 1999, 45, 31-50
    • (1999) Electrochim. Acta , vol.45 , pp. 31-50
    • Winter, M.1    Besenhard, J.O.2
  • 21
    • 77953128331 scopus 로고    scopus 로고
    • Elastic Softening of Amorphous and Crystalline Li-Si Phases with Increasing Li Concentration: A First-Principles Study
    • Shenoy, V. B.; Johari, P.; Qi, Y. Elastic Softening of Amorphous and Crystalline Li-Si Phases with Increasing Li Concentration: A First-Principles Study J. Power Sources 2010, 195, 6825-6830
    • (2010) J. Power Sources , vol.195 , pp. 6825-6830
    • Shenoy, V.B.1    Johari, P.2    Qi, Y.3
  • 22
    • 84857479022 scopus 로고    scopus 로고
    • Elastic Behavior of Crystalline Li-Sn Phases with Increasing Li Concentration
    • Stournara, M. E.; Guduru, P. R.; Shenoy, V. B. Elastic Behavior of Crystalline Li-Sn Phases with Increasing Li Concentration J. Power Sources 2012, 208, 165-169
    • (2012) J. Power Sources , vol.208 , pp. 165-169
    • Stournara, M.E.1    Guduru, P.R.2    Shenoy, V.B.3
  • 23
    • 84859726509 scopus 로고    scopus 로고
    • The First-Cycle Electrochemical Lithiation of Crystalline Ge: Dopant and Orientation Dependence and Comparison with Si
    • Chan, M. K. Y.; Long, B. R.; Gewirth, A. A.; Greeley, J. P. The First-Cycle Electrochemical Lithiation of Crystalline Ge: Dopant and Orientation Dependence and Comparison with Si J. Phys. Chem. Lett. 2011, 2, 3092-3095
    • (2011) J. Phys. Chem. Lett. , vol.2 , pp. 3092-3095
    • Chan, M.K.Y.1    Long, B.R.2    Gewirth, A.A.3    Greeley, J.P.4
  • 24
    • 80053924028 scopus 로고    scopus 로고
    • A Comparative First-Principles Study of the Structure, Energetics, and Properties of Li-M (M = Si, Ge, Sn) Alloys
    • Chou, C.-Y.; Kim, H.; Hwang, G. S. A Comparative First-Principles Study of the Structure, Energetics, and Properties of Li-M (M = Si, Ge, Sn) Alloys J. Phys. Chem. C 2011, 115, 20018-20026
    • (2011) J. Phys. Chem. C , vol.115 , pp. 20018-20026
    • Chou, C.-Y.1    Kim, H.2    Hwang, G.S.3
  • 26
    • 25744460922 scopus 로고
    • Pojector Augmented-Wave Method
    • Blöchl, P. E. Pojector Augmented-Wave Method Phys. Rev. B 1994, 50, 17953-17979
    • (1994) Phys. Rev. B , vol.50 , pp. 17953-17979
    • Blöchl, P.E.1
  • 27
    • 12844286241 scopus 로고
    • Ab Initio Molecular Dynamics of Liquid Metals
    • Kresse, G.; Hafner, J. Ab Initio Molecular Dynamics of Liquid Metals Phys. Rev. B 1993, 47, 558-561
    • (1993) Phys. Rev. B , vol.47 , pp. 558-561
    • Kresse, G.1    Hafner, J.2
  • 28
    • 0030190741 scopus 로고    scopus 로고
    • Efficiency of Ab-Initio Total Energy Calculations for Metals and Semiconductors Using a Plane-Wave Basis Set
    • Kresse, G.; Furthmuller, J. Efficiency of Ab-Initio Total Energy Calculations for Metals and Semiconductors Using a Plane-Wave Basis Set Comput. Mater. Sci. 1996, 6, 15-50
    • (1996) Comput. Mater. Sci. , vol.6 , pp. 15-50
    • Kresse, G.1    Furthmuller, J.2
  • 29
    • 2442537377 scopus 로고    scopus 로고
    • Efficient Iterative Schemes for Ab Initio Total-Energy Calculations Using a Plane-Wave Basis Set
    • Kresse, G.; Furthmuller Efficient Iterative Schemes for Ab Initio Total-Energy Calculations Using a Plane-Wave Basis Set J. Phys. Rev. B 1996, 54, 11169-11186
    • (1996) J. Phys. Rev. B , vol.54 , pp. 11169-11186
    • Kresse, G.1    Furthmuller2
  • 30
    • 1842816907 scopus 로고
    • Special Points for Brillouin-Zone Integrations
    • Monkhorst, H. J.; Pack, J. D. Special Points for Brillouin-Zone Integrations Phys. Rev. B 1976, 13, 5188-5192
    • (1976) Phys. Rev. B , vol.13 , pp. 5188-5192
    • Monkhorst, H.J.1    Pack, J.D.2
  • 31
    • 0034513054 scopus 로고    scopus 로고
    • A Climbing Image Nudged Elastic Band Method for Finding Saddle Points and Minimum Energy Paths
    • Henkelman, G.; Uberuaga, B. P.; Jonsson, H. A Climbing Image Nudged Elastic Band Method for Finding Saddle Points and Minimum Energy Paths J. Chem. Phys. 2000, 113, 9901-9904
    • (2000) J. Chem. Phys. , vol.113 , pp. 9901-9904
    • Henkelman, G.1    Uberuaga, B.P.2    Jonsson, H.3
  • 32
    • 79952672319 scopus 로고    scopus 로고
    • Structure and Properties of Li-Si Alloys: A First-Principles Study
    • Kim, H.; Chou, C.-Y.; Ekerdt, J. G.; Hwang, G. S. Structure and Properties of Li-Si Alloys: A First-Principles Study J. Phys. Chem. C 2011, 115, 2514-2521
    • (2011) J. Phys. Chem. C , vol.115 , pp. 2514-2521
    • Kim, H.1    Chou, C.-Y.2    Ekerdt, J.G.3    Hwang, G.S.4
  • 34
  • 37
    • 0000311055 scopus 로고
    • The Compressibility of Media Under Extreme Pressures
    • Murnaghan, F. D. The Compressibility of Media Under Extreme Pressures Proc. Natl. Acad. Sci. U. S. A. 1944, 30, 244-247
    • (1944) Proc. Natl. Acad. Sci. U. S. A. , vol.30 , pp. 244-247
    • Murnaghan, F.D.1
  • 38
    • 84868468950 scopus 로고    scopus 로고
    • Elastic Softening of Alloy Negative Electrodes for Na-Ion Batteries
    • Mortazavi, M.; Deng, J.; Shenoy, V. B.; Medhekar, N. V. Elastic Softening of Alloy Negative Electrodes for Na-Ion Batteries J. Power Sources 2013, 225, 207-214
    • (2013) J. Power Sources , vol.225 , pp. 207-214
    • Mortazavi, M.1    Deng, J.2    Shenoy, V.B.3    Medhekar, N.V.4
  • 39
    • 0034826146 scopus 로고    scopus 로고
    • First-Principles Studies of the Stability of Zintl Ions In Alkali-Tin Alloys: I. Crystalline Intermetallic Compounds
    • Genser, O.; Hafner, J. First-Principles Studies of the Stability of Zintl Ions In Alkali-Tin Alloys: I. Crystalline Intermetallic Compounds J. Phys.: Condens. Matter. 2001, 13, 959-980
    • (2001) J. Phys.: Condens. Matter. , vol.13 , pp. 959-980
    • Genser, O.1    Hafner, J.2
  • 40
    • 0037142382 scopus 로고    scopus 로고
    • Apparent Anomalous Prefactor Enhancement for Surface Diffusion Due to Surface Defects
    • Wang, X. R.; Xiao, X.; Zhang, Z. Apparent Anomalous Prefactor Enhancement for Surface Diffusion Due to Surface Defects Surf. Sci. 2002, 512, L361-L366
    • (2002) Surf. Sci. , vol.512 , pp. L361-L366
    • Wang, X.R.1    Xiao, X.2    Zhang, Z.3
  • 41
    • 84899877455 scopus 로고    scopus 로고
    • On the Origin of the Significant Difference in Lithiation Behavior Between Silicon and Germanium
    • Chou, C.-Y.; Hwang, G. S. On the Origin of the Significant Difference in Lithiation Behavior Between Silicon and Germanium J. Power Sources 2014, 263, 252-258
    • (2014) J. Power Sources , vol.263 , pp. 252-258
    • Chou, C.-Y.1    Hwang, G.S.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.