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Volumn 46, Issue 5, 2013, Pages 1171-1180

Recent advances in first principles computational research of cathode materials for lithium-ion batteries

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EID: 84878244615     PISSN: 00014842     EISSN: 15204898     Source Type: Journal    
DOI: 10.1021/ar2002396     Document Type: Article
Times cited : (143)

References (45)
  • 1
    • 66849135136 scopus 로고    scopus 로고
    • First principles computational materials design for energy storage materials in lithium ion batteries
    • Meng, Y. S.; Arroyo-de Dompablo, M. E. First principles computational materials design for energy storage materials in lithium ion batteries Energy Environ. Sci. 2009, 2, 589-609
    • (2009) Energy Environ. Sci. , vol.2 , pp. 589-609
    • Meng, Y.S.1    Arroyo-De Dompablo, M.E.2
  • 3
    • 80052434040 scopus 로고    scopus 로고
    • Evaluation of Tavorite-Structured Cathode Materials for Lithium-Ion Batteries Using High-Throughput Computing
    • Mueller, T.; Hautier, G.; Jain, A.; Ceder, G. Evaluation of Tavorite-Structured Cathode Materials for Lithium-Ion Batteries Using High-Throughput Computing Chem. Mater. 2011, 23, 3854-3862
    • (2011) Chem. Mater. , vol.23 , pp. 3854-3862
    • Mueller, T.1    Hautier, G.2    Jain, A.3    Ceder, G.4
  • 4
    • 79961082148 scopus 로고    scopus 로고
    • Phosphates as Lithium-Ion Battery Cathodes: An Evaluation Based on High-Throughput ab Initio Calculations
    • Hautier, G.; Jain, A.; Ong, S. P.; Kang, B.; Moore, C.; Doe, R.; Ceder, G. Phosphates as Lithium-Ion Battery Cathodes: An Evaluation Based on High-Throughput ab Initio Calculations Chem. Mater. 2011, 23, 3495-3508
    • (2011) Chem. Mater. , vol.23 , pp. 3495-3508
    • Hautier, G.1    Jain, A.2    Ong, S.P.3    Kang, B.4    Moore, C.5    Doe, R.6    Ceder, G.7
  • 5
    • 33750954201 scopus 로고    scopus 로고
    • Nazri, G.-A. Pistoia, G. Kluwer Academic Publishers: New York
    • Van der Ven, A.; Ceder, G. In Lithium Batteries; Nazri, G.-A.; Pistoia, G., Eds.; Kluwer Academic Publishers: New York, 2004; pp 42-84.
    • (2004) Lithium Batteries , pp. 42-84
    • Van Der Ven, A.1    Ceder, G.2
  • 6
    • 33749000896 scopus 로고    scopus 로고
    • Factors that affect Li mobility in layered lithium transition metal oxides
    • Kang, K.; Ceder, G. Factors that affect Li mobility in layered lithium transition metal oxides Phys. Rev. B 2006, 74, 094105-1-094105-7
    • (2006) Phys. Rev. B , vol.74 , pp. 0941051-0941057
    • Kang, K.1    Ceder, G.2
  • 7
    • 33244474899 scopus 로고    scopus 로고
    • Electrodes with high power and high capacity for rechargeable lithium batteries
    • Kang, K. S.; Meng, Y. S.; Breger, J.; Grey, C. P.; Ceder, G. Electrodes with high power and high capacity for rechargeable lithium batteries Science 2006, 311, 977-980
    • (2006) Science , vol.311 , pp. 977-980
    • Kang, K.S.1    Meng, Y.S.2    Breger, J.3    Grey, C.P.4    Ceder, G.5
  • 10
    • 79958057242 scopus 로고    scopus 로고
    • Identifying surface structural changes in layered Li-excess nickel manganese oxides in high voltage lithium ion batteries: A joint experimental and theoretical study
    • Xu, B.; Fell, C. R.; Chi, M. F.; Meng, Y. S. Identifying surface structural changes in layered Li-excess nickel manganese oxides in high voltage lithium ion batteries: A joint experimental and theoretical study Energy Environ. Sci. 2011, 4, 2223-2233
    • (2011) Energy Environ. Sci. , vol.4 , pp. 2223-2233
    • Xu, B.1    Fell, C.R.2    Chi, M.F.3    Meng, Y.S.4
  • 11
    • 0025398713 scopus 로고
    • Electrochemistry of Manganese Dioxide in Lithium Nonaqueous Cell III. X-Ray Diffractional Study on the Reduction of Spinel-Related Manganese Dioxide
    • Ohzuku, T.; Kitagawa, M.; Hirai, T. Electrochemistry of Manganese Dioxide in Lithium Nonaqueous Cell III. X-Ray Diffractional Study on the Reduction of Spinel-Related Manganese Dioxide J. Electrochem. Soc. 1990, 137, 769-775
    • (1990) J. Electrochem. Soc. , vol.137 , pp. 769-775
    • Ohzuku, T.1    Kitagawa, M.2    Hirai, T.3
  • 12
    • 77950295954 scopus 로고    scopus 로고
    • 4-A first-principles study by GGA and GGA+U methods
    • 4-A first-principles study by GGA and GGA+U methods J. Power Sources 2010, 195, 4971-4976
    • (2010) J. Power Sources , vol.195 , pp. 4971-4976
    • Xu, B.1    Meng, Y.S.2
  • 16
    • 0032071810 scopus 로고    scopus 로고
    • Tuning the position of the redox couples in materials with NASICON structure by anionic substitution
    • Padhi, A. K.; Manivannan, V.; Goodenough, J. B. Tuning the position of the redox couples in materials with NASICON structure by anionic substitution J. Electrochem. Soc. 1998, 145, 1518-1520
    • (1998) J. Electrochem. Soc. , vol.145 , pp. 1518-1520
    • Padhi, A.K.1    Manivannan, V.2    Goodenough, J.B.3
  • 17
    • 33750954201 scopus 로고    scopus 로고
    • Nazri, G.-A. Pistoia, G. Kluwer Academic Publishers: New York
    • Masquelier, C.; Patoux, S.; Wurm, C.; Morcrette, M. In Lithium Batteries; Nazri, G.-A.; Pistoia, G., Eds.; Kluwer Academic Publishers: New York, 2004; pp 445-477.
    • (2004) Lithium Batteries , pp. 445-477
    • Masquelier, C.1    Patoux, S.2    Wurm, C.3    Morcrette, M.4
  • 20
    • 33644979781 scopus 로고    scopus 로고
    • 4 and their association with lithium ions and vacancies
    • 4 and their association with lithium ions and vacancies Phys. Rev. B 2006, 73, 104301-1-104301-7
    • (2006) Phys. Rev. B , vol.73 , pp. 1043011-1043017
    • Maxisch, T.1    Zhou, F.2    Ceder, G.3
  • 24
    • 35648959236 scopus 로고    scopus 로고
    • 4: Surface energy, structure, Wulff shape, and surface redox potential
    • 4: Surface energy, structure, Wulff shape, and surface redox potential Phys. Rev. B 2007, 76, 16435-1-16435-11
    • (2007) Phys. Rev. B , vol.76 , pp. 164351-1643511
    • Wang, L.1    Zhou, F.2    Meng, Y.S.3    Ceder, G.4
  • 25
    • 77958062164 scopus 로고    scopus 로고
    • Particle Size Dependence of the Ionic Diffusivity
    • Malik, R.; Burch, D.; Bazant, M.; Ceder, G. Particle Size Dependence of the Ionic Diffusivity Nanoletters 2010, 10, 4123-4127
    • (2010) Nanoletters , vol.10 , pp. 4123-4127
    • Malik, R.1    Burch, D.2    Bazant, M.3    Ceder, G.4
  • 39
    • 36148984140 scopus 로고    scopus 로고
    • A computational investigation on fluorinated-polyanionic compounds as positive electrode for lithium batteries
    • Arroyo y de Dompablo, M. E.; Amador, U.; Tarascon, J. M. A computational investigation on fluorinated-polyanionic compounds as positive electrode for lithium batteries J. Power Sources 2007, 174, 1251-1257
    • (2007) J. Power Sources , vol.174 , pp. 1251-1257
    • Arroyo De Dompablo, Y.M.E.1    Amador, U.2    Tarascon, J.M.3
  • 45
    • 84878233369 scopus 로고    scopus 로고
    • http://www.materialsproject.org/.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.