Direct Observation of Alternating Octahedral and Prismatic Sodium Layers in O3- Type Transition Metal Oxides
dc.contributor.author | Kim, Jae Chul | |
dc.contributor.author | Kwon, Deok‐hwang | |
dc.contributor.author | Yang, Julia H. | |
dc.contributor.author | Kim, Hyunchul | |
dc.contributor.author | Bo, Shou‐hang | |
dc.contributor.author | Wu, Lijun | |
dc.contributor.author | Kim, Haegyeom | |
dc.contributor.author | Seo, Dong‐hwa | |
dc.contributor.author | Shi, Tan | |
dc.contributor.author | Wang, Jingyang | |
dc.contributor.author | Zhu, Yimei | |
dc.contributor.author | Ceder, Gerbrand | |
dc.date.accessioned | 2020-09-02T14:59:46Z | |
dc.date.available | WITHHELD_12_MONTHS | |
dc.date.available | 2020-09-02T14:59:46Z | |
dc.date.issued | 2020-08 | |
dc.identifier.citation | Kim, Jae Chul; Kwon, Deok‐hwang ; Yang, Julia H.; Kim, Hyunchul; Bo, Shou‐hang ; Wu, Lijun; Kim, Haegyeom; Seo, Dong‐hwa ; Shi, Tan; Wang, Jingyang; Zhu, Yimei; Ceder, Gerbrand (2020). "Direct Observation of Alternating Octahedral and Prismatic Sodium Layers in O3- Type Transition Metal Oxides." Advanced Energy Materials 10(31): n/a-n/a. | |
dc.identifier.issn | 1614-6832 | |
dc.identifier.issn | 1614-6840 | |
dc.identifier.uri | https://hdl.handle.net/2027.42/156453 | |
dc.description.abstract | The oxygen stacking of O3- type layered sodium transition metal oxides (O3- NaTMO2) changes dynamically upon topotactic Na extraction and reinsertion. While the phase transition from octahedral to prismatic Na coordination that occurs at intermediate desodiation by transition metal slab gliding is well understood, the structural evolution at high desodiation, crucial to achieve high reversible capacity, remains mostly uncharted. In this work, the phase transitions of O3- type layered NaTMO2 at high voltage are investigated by combining experimental and computational approaches. An OP2- type phase that consists of alternating octahedral and prismatic Na layers is directly observed by in situ X- ray diffraction and high- resolution scanning transmission electron microscopy. The origin of this peculiar phase is explained by atomic interactions involving Jahn- Teller active Fe4+ and distortion tolerant Ti4+ that stabilize the local Na environment. The path- dependent desodiation and resodiation pathways are also rationalized in this material through the different kinetics of the prismatic and octahedral layers, presenting a comprehensive picture about the structural stability of the layered materials upon Na intercalation.A novel phase transition to an OP2- type stacking sequence from an O3- layered sodium transition metal oxide (NaTi0.25Fe0.25Co0.25Mn0.25O2) is directly observed and investigated by in situ X- ray diffraction, high- resolution scanning transmission electron microscopy, and first- principles calculations. This study discusses how Jahn- Teller active Fe4+ ion promotes OP2 formation, which leads to hysteresis during resodiation. | |
dc.publisher | Springer Nature | |
dc.publisher | Wiley Periodicals, Inc. | |
dc.subject.other | energy storage | |
dc.subject.other | layered structure | |
dc.subject.other | Na- ion batteries | |
dc.subject.other | O3 structure | |
dc.subject.other | OP2 structure | |
dc.title | Direct Observation of Alternating Octahedral and Prismatic Sodium Layers in O3- Type Transition Metal Oxides | |
dc.type | Article | |
dc.rights.robots | IndexNoFollow | |
dc.subject.hlbsecondlevel | Materials Science and Engineering | |
dc.subject.hlbtoplevel | Engineering | |
dc.description.peerreviewed | Peer Reviewed | |
dc.description.bitstreamurl | http://deepblue.lib.umich.edu/bitstream/2027.42/156453/3/aenm202001151.pdf | en_US |
dc.description.bitstreamurl | http://deepblue.lib.umich.edu/bitstream/2027.42/156453/2/aenm202001151-sup-0001-SuppMat.pdf | en_US |
dc.description.bitstreamurl | http://deepblue.lib.umich.edu/bitstream/2027.42/156453/1/aenm202001151_am.pdf | en_US |
dc.identifier.doi | 10.1002/aenm.202001151 | |
dc.identifier.source | Advanced Energy Materials | |
dc.identifier.citedreference | M. Aydinol, A. Kohan, G. Ceder, K. Cho, J. Joannopoulos, Phys. Rev. B: Condens. Matter Mater. Phys. 1997, 56, 1354. | |
dc.identifier.citedreference | M. Sathiya, J. Thomas, D. Batuk, V. Pimenta, R. Gopalan, J. M. Tarascon, Chem. Mater. 2017, 29, 5948. | |
dc.identifier.citedreference | M. Jeong, H. Lee, J. Yoon, W.- S. Yoon, J. Power Sources 2019, 439, 227064. | |
dc.identifier.citedreference | E. Talaie, V. Duffort, H. L. Smith, B. Fultz, L. F. Nazar, Energy Environ. Sci. 2015, 8, 2512. | |
dc.identifier.citedreference | N. Yabuuchi, M. Kajiyama, J. Iwatate, H. Nishikawa, S. Hitomi, R. Okuyama, R. Usui, Y. Yamada, S. Komaba, Nat. Mater. 2012, 11, 512. | |
dc.identifier.citedreference | D. D. Yuan, Y. X. Wang, Y. L. Cao, X. P. Ai, H. X. Yang, ACS Appl. Mater. Interfaces 2015, 7, 8585. | |
dc.identifier.citedreference | R. Berthelot, M. Pollet, D. Carlier, C. Delmas, Inorg. Chem. 2011, 50, 2420. | |
dc.identifier.citedreference | J. W. Somerville, A. Sobkowiak, N. Tapia- Ruiz, J. Billaud, J. G. Lozano, R. A. House, L. C. Gallington, T. Ericsson, L. Häggström, M. R. Roberts, U. Maitra, P. G. Bruce, Energy Environ. Sci. 2019, 12, 2223. | |
dc.identifier.citedreference | P. Vassilaras, S. T. Dacek, H. Kim, T. T. Fister, S. Kim, G. Ceder, J. C. Kim, J. Electrochem. Soc. 2017, 164, A3484. | |
dc.identifier.citedreference | J. L. Yue, Y. N. Zhou, X. Yu, S. M. Bak, X. Q. Yang, Z. W. Fu, J. Mater. Chem. A 2015, 3, 23261. | |
dc.identifier.citedreference | V. F. Sears, Neutron News 1992, 3, 26. | |
dc.identifier.citedreference | C. Ma, J. Alvarado, J. Xu, R. J. Clément, M. Kodur, W. Tong, C. P. Grey, Y. S. Meng, J. Am. Chem. Soc. 2017, 139, 4835. | |
dc.identifier.citedreference | S. J. Pennycook, Scanning Transmission Electron Microscopy, Springer Nature, New York 2011. | |
dc.identifier.citedreference | E. J. Kirkland, Advanced Computing in Electron Microscopy, Springer Nature, New York 2010. | |
dc.identifier.citedreference | S. J. Pennycook, P. D. Nellist, Scanning Transmission Electron Microscopy, Springer Nature, New York 2011. | |
dc.identifier.citedreference | S. Guo, Y. Sun, J. Yi, K. Zhu, P. Liu, Y. Zhu, G. Zhu, M. Chen, M. Ishida, H. Zhou, NPG Asia Mater. 2016, 8, e266. | |
dc.identifier.citedreference | S. Muhammad, H. Kim, Y. Kim, D. Kim, J. H. Song, J. Yoon, J.- H. Park, S.- J. Ahn, S.- H. Kang, M. M. Thackeray, W.- S. Yoon, Nano Energy 2016, 21, 172. | |
dc.identifier.citedreference | A. Van Der Ven, J. Bhattacharya, A. A. Belak, Acc. Chem. Res. 2013, 46, 1216. | |
dc.identifier.citedreference | X. Lu, L. Gu, Y. S. Hu, H. C. Chiu, H. Li, G. P. Demopoulos, L. Chen, J. Am. Chem. Soc. 2015, 137, 1581. | |
dc.identifier.citedreference | Y. Hinuma, H. Hayashi, Y. Kumagai, I. Tanaka, F. Oba, Phys. Rev. B 2017, 96, 094102. | |
dc.identifier.citedreference | J. H. Yang, D. A. Kitchaev, G. Ceder, Phys. Rev. B 2019, 100, 035132. | |
dc.identifier.citedreference | J. L. Kaufman, A. Van Der Ven, Phys. Rev. Mater. 2019, 3, 015402. | |
dc.identifier.citedreference | X. Li, D. Wu, Y. N. Zhou, L. Liu, X. Q. Yang, G. Ceder, Electrochem. Commun. 2014, 49, 51. | |
dc.identifier.citedreference | X. Chen, S. Hwang, R. Chisnell, Y. Wang, F. Wu, S. Kim, J. W. Lynn, D. Su, X. Li, Adv. Funct. Mater. 2018, 28, 1803896. | |
dc.identifier.citedreference | P. Vassilaras, D. H. Kwon, S. T. Dacek, T. Shi, D. H. Seo, G. Ceder, J. C. Kim, J. Mater. Chem. A 2017, 5, 4596. | |
dc.identifier.citedreference | S. Maletti, A. Sarapulova, A. Schökel, D. Mikhailova, ACS Appl. Mater. Interfaces 2019, 11, 33923. | |
dc.identifier.citedreference | C. A. Marianetti, D. Morgan, G. Ceder, Phys. Rev. B: Condens. Matter Mater. Phys. 2001, 63, 224304. | |
dc.identifier.citedreference | R. J. Clément, Z. Lun, G. Ceder, Energy Environ. Sci. 2020, 13, 345. | |
dc.identifier.citedreference | A. Urban, A. Abdellahi, S. Dacek, N. Artrith, G. Ceder, Phys. Rev. Lett. 2017, 119, 176402. | |
dc.identifier.citedreference | Y. Mo, S. P. Ong, G. Ceder, Chem. Mater. 2014, 26, 5208. | |
dc.identifier.citedreference | C. L. Farrow, P. Juhas, J. W. Liu, D. Bryndin, E. S. Boin, J. Bloch, T. Proffen, S. J. L. Billinge, J. Phys.: Condens. Matter 2007, 19, 335219. | |
dc.identifier.citedreference | C. Shahi, J. Sun, J. P. Perdew, Phys. Rev. B 2018, 97, 094111. | |
dc.identifier.citedreference | D. A. Kitchaev, H. Peng, Y. Liu, J. Sun, J. P. Perdew, G. Ceder, Phys. Rev. B 2016, 93, 045132. | |
dc.identifier.citedreference | S. P. Ong, W. D. Richards, A. Jain, G. Hautier, M. Kocher, S. Cholia, D. Gunter, V. L. Chevrier, K. A. Persson, G. Ceder, Comput. Mater. Sci. 2013, 68, 314. | |
dc.identifier.citedreference | P. F. Wang, H. R. Yao, X. Y. Liu, Y. X. Yin, J. N. Zhang, Y. Wen, X. Yu, L. Gu, Y. G. Guo, Sci. Adv. 2018, 4, eaar6018. | |
dc.identifier.citedreference | H. Yu, Y. Ren, D. Xiao, S. Guo, Y. Zhu, Y. Qian, L. Gu, H. Zhou, Angew. Chem., Int. Ed. 2014, 53, 8963. | |
dc.identifier.citedreference | H. R. Yao, P. F. Wang, Y. Gong, J. Zhang, X. Yu, L. Gu, C. Ouyang, Y. X. Yin, E. Hu, X. Q. Yang, E. Stavitski, Y. G. Guo, L. J. Wan, J. Am. Chem. Soc. 2017, 139, 8440. | |
dc.identifier.citedreference | X. Li, Y. Wang, D. Wu, L. Liu, S. H. Bo, G. Ceder, Chem. Mater. 2016, 28, 6575. | |
dc.identifier.citedreference | M. Guilmard, C. Pouillerie, L. Croguennec, C. Delmas, Solid State Ionics 2003, 160, 39. | |
dc.identifier.citedreference | G. X. Wang, J. Horvat, D. H. Bradhurst, H. K. Liu, S. X. Dou, J. Power Sources 2000, 85, 279. | |
dc.identifier.citedreference | H. Kim, H. Kim, Z. Ding, M. H. Lee, K. Lim, G. Yoon, K. Kang, Adv. Energy Mater. 2016, 6, 1600943. | |
dc.identifier.citedreference | N. Yabuuchi, K. Kubota, M. Dahbi, S. Komaba, Chem. Rev. 2014, 114, 11636. | |
dc.identifier.citedreference | C. Delmas, C. Fouassier, P. Hagenmuller, Physica B+C 1980, 99, 81. | |
dc.identifier.citedreference | S. P. Ong, V. L. Chevrier, G. Hautier, A. Jain, C. Moore, S. Kim, X. Ma, G. Ceder, Energy Environ. Sci. 2011, 4, 3680. | |
dc.identifier.citedreference | J. Reed, G. Ceder, Electrochem. Solid- State Lett. 2002, 5, 145. | |
dc.identifier.citedreference | J. Reed, G. Ceder, Chem. Rev. 2004, 104, 4513. | |
dc.identifier.citedreference | S. W. Kim, D. H. Seo, X. Ma, G. Ceder, K. Kang, Adv. Energy Mater. 2012, 2, 710. | |
dc.identifier.citedreference | H. Yao, P. Wang, Y. Wang, X. Yu, Y. Yin, Y. Guo, Adv. Energy Mater. 2017, 7, 1700189. | |
dc.identifier.citedreference | C. Zhao, F. Ding, Y. Lu, L. Chen, Y. S. Hu, Angew. Chem., Int. Ed. 2020, 59, 264. | |
dc.owningcollname | Interdisciplinary and Peer-Reviewed |
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