Low Li+ binding affinity: An important characteristic for additives to form solid electrolyte interphases in Li-ion batteries

Journal of Power Sources

Volumn 196, Issue 11, 2011, Pages 5109-5114

  Park, Min Hee ^a   Lee, Yoon Sup ^a   Lee, Hochun ^b   Han, Young Kyu ^c  

^a Korea Advanced Institute of Science and Technology (KAIST)   (South Korea)

^b Kumoh National Institute of Technology   (South Korea)

^c Korea Basic Science Institute (KBSI)   (South Korea)

Author keywords

Binding affinity; Density functional theory; Electrolyte additive; Lithium ion battery; Solid electrolyte interphase

Indexed keywords

BINDING AFFINITIES; CHEMICAL HARDNESS; ELECTROLYTE ADDITIVE; ELECTROLYTE ADDITIVES; ION BINDING; LI-ION BATTERIES; LITHIUM-ION BATTERY; LOWEST UNOCCUPIED MOLECULAR ORBITAL; ORGANIC MOLECULES; SCREENING PROCESS; SOLID ELECTROLYTE INTERPHASE;

ADDITIVES; DENSITY FUNCTIONAL THEORY; IONS; LITHIUM; LITHIUM ALLOYS; LITHIUM BATTERIES; LITHIUM COMPOUNDS; MOLECULAR ORBITALS; SEEBECK EFFECT; SOLID ELECTROLYTES;

BINDING ENERGY;

EID: 79952993731     PISSN: 03787753     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jpowsour.2011.01.106     Document Type: Article

References (56)

1. K. Xu Chem. Rev. 104 2004 4303
2. P. Verma, P. Maire, and P. Novak Electrochim. Acta 55 2010 6332
3. K. Xu Energies 3 2010 135
4. M.D. Halls, and K. Tasaki J. Power Sources 195 2010 1472
5. J. Greeley, T.F. Jaramillo, J. Bonde, I. Chorkendorff, and J.K. Nørskov Nat. Mater. 5 2006 909
6. B. Simon, J.-P. Boeuve, US Patent 5,626,981 (1997).
7. P. Biensan, J.M. Bodet, F. Perton, M. Broussely, C. Jehoulet, S. Barusseau, S. Herreyre, B. Simon, Paper 286 Presented at the 10th International Meeting on Lithium Batteries, Como, Italy, May 28-June 2, 2000.
8. D. Aurbach, K. Gamolsky, B. Markovsky, Y. Gofer, M. Schmidt, and U. Heider Electrochim. Acta 47 2002 1423
9. M. Kotato, T. Fujii, N. Shima, H. Suzuki, JP Patent 4,211,159 (2008).
10. Y. Hu, W. Kong, H. Li, X. Huang, and L. Chen Electrochem. Commun. 6 2004 126
11. S. Kinoshita, M. Kotato, Y. Sakata, M. Ue, Y. Watanabe, H. Morimoto, and S. Tobishima J. Power Sources 183 2008 755
12. R. McMillan, H. Slegr, Z.X. Shu, and W. Wang J. Power Sources 81-82 1999 20
13. S.-K. Jeong, M. Inaba, R. Mogi, Y. Iriyama, T. Abe, and Z. Ogumi Langmuir 17 2001 8281
14. R. Mogi, M. Inaba, Y. Iriyama, T. Abe, and Z. Ogumi Langmuir 19 2003 814
15. M. Inaba, Y. Kawatate, A. Funabiki, S. Jeong, T. Abe, and Z. Ogumi Electrochim. Acta 45 1999 99
16. X.J. Wanga, H.S. Lee, H. Li, X.Q. Yang, and X.J. Huang Electrochem. Commun. 12 2010 386
17. G.-B. Han, M.-H. Ryou, K.Y. Cho, Y.M. Lee, and J.-K. Park J. Power Sources 195 2010 3709
18. J. Ufheil, M.C. Baertsch, A. Würsig, and P. Novák Electrochim. Acta 50 2005 1733
19. S. Naruse, T. Amazutsumi, S. Morita, N. Nishiguchi, K. Kita, M. Muraki, JP Patent 2004-54166 (2004).
20. S.S. Zhang J. Power Sources 162 2006 1379
21. A. Naji, J. Ghanbaja, P. Willmann, and D. Billaud Electrochim. Acta 45 2000 1893
22. K. Abe, H. Yoshitake, T. Kitakura, T. Hattori, H. Wang, and M. Yoshio Electrochim. Acta 49 2004 4613
23. G.H. Wrodnigg, J.O. Besenhard, and M. Winter J. Electrochem. Soc. 146 1999 470
24. X. Zuo, M. Xu, W. Li, D. Su, and J. Liu Electrochem. Solid-State Lett. 9 2006 A196
25. A. Hinohara, T. Ishida, C. Hirano, T. Hayashi, JP Patent 4,190,162 (2008).
26. M.Q. Xu, W.S. Li, X.X. Zuo, J.S. Liu, and X. Xu J. Power Sources 174 2007 705
27. G.H. Wrodnigg, T.M. Wrodnigg, J.O. Besenhard, and M. Winter Electrochem. Commun. 1 1999 148
28. R. Chen, F. Wu, L. Li, Y. Guan, X. Qiu, S. Chen, Y. Li, and S. Wu J. Power Sources 172 2007 395
29. B.T. Yu, W.H. Qiu, F.S. Li, and L. Cheng J. Power Sources 158 2006 1373
30. G.H. Wrodnigg, J.O. Besenhard, and M. Winter J. Power Sources 97-98 2001 592
31. H.-S. Kim, J.-S. Kim, M.-D. Cho, H.-S. Lee, D.-M. Im, US Patent 7,514,182 (2009).
32. K. Morigaki, T. Teraoka, N. Kabuto, K. Haraguchi, JP Patent 3,060,796 (2000).
33. H. Lee, J.-J. Cho, KR Patent 0,898,857 (2008).
34. S. Yoon, J.-J. Cho, H. Lee, KR Patent 2008-0008151 (2008).
35. C. Korepp, H.J. Santner, T. Fujii, M. Ue, J.O. Besenhard, K.-C. Möller, and M. Winter J. Power Sources 158 2006 578
36. W. Yao, Z. Zhang, J. Gao, J. Li, J. Xu, Z. Wang, and Y. Yang Energy Environ. Sci. 2 2009 1102
37. P. Johansson J. Phys. Chem. A110 2006 12077
38. C. Buhrmester, L. Moshurchak, R.L. Wang, and J.R. Dahn J. Electrochem. Soc. 153 2006 A288
39. R.L. Wang, C. Buhrmester, and J.R. Dahn J. Electrochem. Soc. 153 2006 A445
40. R.L. Wang, and J.R. Dahn J. Electrochem. Soc. 153 2006 A1922
41. A.D. Becke J. Chem. Phys. 98 1993 5648
42. S.J. Vosko, L. Wilk, and M. Nusair Can. J. Chem. 58 1980 1200
43. A.D. Becke Phys. Rev. A38 1988 3098
44. V. Barone, M. Cossi, and J. Tomasi J. Comput. Chem. 19 1998 404
45. S.S. Zhang, T.R. Jow, K. Amine, and G.L. Henriksen J. Power Sources 107 2002 18
46. M.J. Frisch, G.W. Trucks, H.B. Schlegel, G.E. Scuseria, M.A. Robb, J.R. Cheeseman, J.A. Montgomery Jr., T. Vreven, K.N. Kudin, J.C. Burant, J.M. Millam, S.S. Iyengar, J. Tomasi, V. Barone, B. Mennucci, M. Cossi, G. Scalmani, N. Rega, G.A. Petersson, H. Nakatsuji, M. Hada, M. Ehara, K. Toyota, R. Fukuda, J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda, O. Kitao, H. Nakai, M. Klene, X. Li, J.E. Knox, H.P. Hratchian, J.B. Cross, C. Adamo, J. Jaramillo, R. Gomperts, R.E. Stratmann, O. Yazyev, A.J. Austin, R. Cammi, C. Pomelli, J.W. Ochterski, P.Y. Ayala, K. Morokuma, G.A. Voth, P. Salvador, J.J. Dannenberg, V.G. Zakrzewski, S. Dapprich, A.D. Daniels, M.C. Strain, O. Farkas, D.K. Malick, A.D. Rabuck, K. Raghavachari, J.B. Foresman, J.V. Ortiz, Q. Cui, A.G. Baboul, S. Clifford, J. Cioslowski, B.B. Stefanov, G. Liu, A. Liashenko, P. Piskorz, I. Komaromi, R.L. Martin, D.J. Fox, T. Keith, M.A. Al-Laham, C.Y. Peng, A. Nanayakkara, M. Challacombe, P.M.W. Gill, B. Johnson, W. Chen, M.W. Wong, C. Gonzalez, and J.A. Pople Gaussian 03, Revision C.02 2003 Gaussian, Inc. Pittsburgh, PA
47. M. Inaba, and Z. Ogumi Lithium-Ion Batteries: Solid-Electrolyte Interphase 2004 World Scientific Publishing Co. Singapore Chapter 4, pp. 198-226
48. N.I. Hammer, R.J. Hinde, R.N. Compton, K. Diri, K.D. Jordan, D. Radisic, S.T. Stokes, and K.T. Bowen J. Chem. Phys. 120 2004 685
49. Y.-K. Han, J. Jung, S. Yu, and H. Lee J. Power Sources 187 2009 581
50. Y. Wang, and P.B. Balbuena Lithium-Ion Batteries: Solid-Electrolyte Interphase 2004 World Scientific Publishing Co. Singapore Chapter 5, pp. 227-275
51. F. Sagane, T. Abe, and Z. Ogumi J. Phys. Chem. C 113 2009 20135
52. K. Xu, A. von Cresce, and U. Lee Langmuir 26 2010 11538
53. S. Kobayashi, and Y. Uchimoto J. Phys. Chem. B 109 2005 13322
54. Y. Wang, and P.B. Balbuena Lithium-Ion Batteries: Solid-Electrolyte Interphase 2004 World Scientific Publishing Co. Singapore Chapter 9, pp. 365-397
55. K. Tasaki, A. Goldberg, J.-J. Lian, M. Walker, A. Timmons, and S.J. Harris J. Electrochem. Soc. 156 2009 A1019
56. K. Tasaki, and S.J. Harris J. Phys. Chem. C 114 2010 8076