Theoretical Investigation of Quantum Capacitance of M 2 C MXenes as Supercapacitor Electrode

MXenes are promising electrode materials due to their excellent performance. However, the quantum capacitance ( C diff ) and surface storage charge ( Q ) of bare M 2 C are little reported theoretically up to now. Herein, C diff and Q of 12 M 2 C MXenes related with 3d, 4d, and 5d transition metal (T...

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Published inphysica status solidi (b) Vol. 260; no. 12
Main Authors Yin, She-Hui, Li, Xiao-Hong, Cui, Hong-Ling
Format Journal Article
LanguageEnglish
Published 01.12.2023
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Abstract MXenes are promising electrode materials due to their excellent performance. However, the quantum capacitance ( C diff ) and surface storage charge ( Q ) of bare M 2 C are little reported theoretically up to now. Herein, C diff and Q of 12 M 2 C MXenes related with 3d, 4d, and 5d transition metal (TM) atoms are investigated in aqueous and ionic/organic systems. All M 2 C MXenes are metallic. M 2 C with 5d TM are cathode materials. M 2 C with 4d TM are also cathode materials except Y 2 C MXene. For M 2 C with 3d TM, Sc 2 C and Mn 2 C are cathode materials, while Ti 2 C, V 2 C, and Cr 2 C are anode materials, especially for Ti 2 C and V 2 C with larger | Q p |/| Q n | and Q p . The broadened voltage maintains the type of electrode materials. W 2 C is the least promising cathode material in broad voltage.
AbstractList MXenes are promising electrode materials due to their excellent performance. However, the quantum capacitance ( C diff ) and surface storage charge ( Q ) of bare M 2 C are little reported theoretically up to now. Herein, C diff and Q of 12 M 2 C MXenes related with 3d, 4d, and 5d transition metal (TM) atoms are investigated in aqueous and ionic/organic systems. All M 2 C MXenes are metallic. M 2 C with 5d TM are cathode materials. M 2 C with 4d TM are also cathode materials except Y 2 C MXene. For M 2 C with 3d TM, Sc 2 C and Mn 2 C are cathode materials, while Ti 2 C, V 2 C, and Cr 2 C are anode materials, especially for Ti 2 C and V 2 C with larger | Q p |/| Q n | and Q p . The broadened voltage maintains the type of electrode materials. W 2 C is the least promising cathode material in broad voltage.
Author Yin, She-Hui
Li, Xiao-Hong
Cui, Hong-Ling
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Cites_doi 10.1021/jp401820b
10.3390/nano10040695
10.1063/1.1803614
10.1039/D0RA06773C
10.1063/1.3382344
10.1021/acs.chemrev.6b00558
10.1088/2515-7655/ab9b1d
10.1103/PhysRevLett.77.3865
10.1021/nl802558y
10.1021/acs.jpcc.9b03563
10.1021/acs.energyfuels.2c02808
10.1039/C8NR01550C
10.1021/acs.jpcc.5b10366
10.1038/natrevmats.2016.98
10.1038/nphoton.2014.271
10.1038/nenergy.2017.105
10.1016/j.ceramint.2017.06.016
10.1016/j.cplett.2021.138666
10.1002/aelm.202000967
10.1016/j.carbon.2016.07.005
10.1016/j.carbon.2013.11.057
10.1002/jcc.20495
10.1063/1.99649
10.1039/C9SC01662G
10.1016/j.matdes.2017.05.052
10.1002/adma.201304138
10.1038/nnano.2008.67
10.1038/nenergy.2017.89
10.1103/PhysRevB.54.11169
10.1063/1.4870515
10.1103/PhysRevB.13.5188
10.1063/1.2182009
10.1002/er.3707
10.1103/PhysRevB.87.245307
10.1557/mrc.2012.25
10.1016/j.est.2023.106703
10.1021/jp507336x
10.1016/j.commatsci.2012.07.011
10.1021/acsanm.2c00533
10.1016/j.electacta.2021.138432
10.1039/C3CP52590B
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References e_1_2_8_28_1
e_1_2_8_29_1
e_1_2_8_24_1
e_1_2_8_25_1
e_1_2_8_26_1
e_1_2_8_27_1
e_1_2_8_3_1
e_1_2_8_2_1
Abhinandan P. (e_1_2_8_4_1) 2022; 54
e_1_2_8_5_1
e_1_2_8_7_1
e_1_2_8_6_1
e_1_2_8_9_1
e_1_2_8_8_1
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e_1_2_8_23_1
e_1_2_8_44_1
e_1_2_8_41_1
e_1_2_8_40_1
e_1_2_8_17_1
e_1_2_8_18_1
e_1_2_8_39_1
e_1_2_8_19_1
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e_1_2_8_33_1
e_1_2_8_30_1
References_xml – ident: e_1_2_8_43_1
  doi: 10.1021/jp401820b
– ident: e_1_2_8_18_1
  doi: 10.3390/nano10040695
– ident: e_1_2_8_35_1
  doi: 10.1063/1.1803614
– ident: e_1_2_8_7_1
  doi: 10.1039/D0RA06773C
– ident: e_1_2_8_33_1
  doi: 10.1063/1.3382344
– ident: e_1_2_8_12_1
  doi: 10.1021/acs.chemrev.6b00558
– ident: e_1_2_8_23_1
  doi: 10.1088/2515-7655/ab9b1d
– ident: e_1_2_8_31_1
  doi: 10.1103/PhysRevLett.77.3865
– ident: e_1_2_8_15_1
  doi: 10.1021/nl802558y
– ident: e_1_2_8_13_1
  doi: 10.1021/acs.jpcc.9b03563
– ident: e_1_2_8_3_1
  doi: 10.1021/acs.energyfuels.2c02808
– ident: e_1_2_8_27_1
  doi: 10.1039/C8NR01550C
– ident: e_1_2_8_19_1
  doi: 10.1021/acs.jpcc.5b10366
– ident: e_1_2_8_29_1
  doi: 10.1038/natrevmats.2016.98
– ident: e_1_2_8_14_1
  doi: 10.1038/nphoton.2014.271
– ident: e_1_2_8_24_1
  doi: 10.1038/nenergy.2017.105
– ident: e_1_2_8_40_1
  doi: 10.1016/j.ceramint.2017.06.016
– volume: 54
  start-page: 05355
  year: 2022
  ident: e_1_2_8_4_1
  publication-title: J. Energy Storage
  contributor:
    fullname: Abhinandan P.
– ident: e_1_2_8_21_1
  doi: 10.1016/j.cplett.2021.138666
– ident: e_1_2_8_17_1
  doi: 10.1002/aelm.202000967
– ident: e_1_2_8_36_1
  doi: 10.1016/j.carbon.2016.07.005
– ident: e_1_2_8_9_1
  doi: 10.1016/j.carbon.2013.11.057
– ident: e_1_2_8_32_1
  doi: 10.1002/jcc.20495
– ident: e_1_2_8_10_1
  doi: 10.1063/1.99649
– ident: e_1_2_8_16_1
  doi: 10.1039/C9SC01662G
– ident: e_1_2_8_20_1
  doi: 10.1016/j.matdes.2017.05.052
– ident: e_1_2_8_25_1
  doi: 10.1002/adma.201304138
– ident: e_1_2_8_11_1
  doi: 10.1038/nnano.2008.67
– ident: e_1_2_8_26_1
  doi: 10.1038/nenergy.2017.89
– ident: e_1_2_8_30_1
  doi: 10.1103/PhysRevB.54.11169
– ident: e_1_2_8_28_1
  doi: 10.1063/1.4870515
– ident: e_1_2_8_34_1
  doi: 10.1103/PhysRevB.13.5188
– ident: e_1_2_8_37_1
  doi: 10.1063/1.2182009
– ident: e_1_2_8_5_1
  doi: 10.1002/er.3707
– ident: e_1_2_8_22_1
  doi: 10.1038/nenergy.2017.105
– ident: e_1_2_8_41_1
  doi: 10.1103/PhysRevB.87.245307
– ident: e_1_2_8_44_1
  doi: 10.1557/mrc.2012.25
– ident: e_1_2_8_2_1
  doi: 10.1016/j.est.2023.106703
– ident: e_1_2_8_39_1
  doi: 10.1021/jp507336x
– ident: e_1_2_8_42_1
  doi: 10.1016/j.commatsci.2012.07.011
– ident: e_1_2_8_6_1
  doi: 10.1021/acsanm.2c00533
– ident: e_1_2_8_38_1
  doi: 10.1016/j.electacta.2021.138432
– ident: e_1_2_8_8_1
  doi: 10.1039/C3CP52590B
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Title Theoretical Investigation of Quantum Capacitance of M 2 C MXenes as Supercapacitor Electrode
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