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Ish: Two-dimensional metallic Si2BC as a promising and high-performance anode material for magnesium-ion batteries: A DFT study

  1. Generalized Gradient Approximation Made Simple

    John P. Perdew, Kieron Burke, Matthias Ernzerhof

    Maqola1996153 iqtibos
    ABI

  2. Efficient iterative schemes for<i>ab initio</i>total-energy calculations using a plane-wave basis set

    Georg Kresse, J. Furthmüller

    Maqola199664 iqtibos
    ABI

  3. Semiempirical GGA‐type density functional constructed with a long‐range dispersion correction

    Stefan Grimme

    Maqola200642 iqtibos
    ABI

  4. First principles methods using CASTEP

    Stewart J. Clark, Matthew Segall, Chris J. Pickard +4

    Maqola200511 iqtibos
    ABI

  5. An all-electron numerical method for solving the local density functional for polyatomic molecules

    B. Delley

    Maqola19907 iqtibos
    ABI

  6. From molecules to solids with the DMol3 approach

    B. Delley

    Maqola20007 iqtibos
    ABI

  7. Density Functional Theory Studies of Si<sub>2</sub>BN Nanosheets as Anode Materials for Magnesium-Ion Batteries

    Puspamitra Panigrahi, Shashi B. Mishra, Tanveer Hussain +2

    Maqola20205 iqtibos
    ABI

  8. The potential application of VS2 as an electrode material for Mg ion battery: A DFT study

    Jingdong Yang, Jinxing Wang, Xiaoyang Dong +5

    Maqola20205 iqtibos
    ABI

  9. Graphene-like BSi as a promising anode material for Li- and Mg-ion batteries: A first principle study

    Xiao Chu, Xianqiong Tang, Jinfeng Peng +1

    Maqola20215 iqtibos
    ABI

  10. Rational design of <scp>h‐AlC</scp> monolayer as anode material for Mg‐ion battery: A <scp>DFT</scp> study

    Nayana Shekh, Darshil Chodvadiya, Prafulla K. Jha

    Maqola20225 iqtibos
    ABI

  11. Building Safe Lithium-Ion Batteries for Electric Vehicles: A Review

    Ji’an Duan, Xuan Tang, Haifeng Dai +4

    Sharh maqola20194 iqtibos
    ABI

  12. Study the application of nitrogenated holey graphene (C2N) nanosheets as a high-performance anode material for magnesium ion battery (MIB): DFT study

    Mustafa M. Kadhim, Mohammed Abdul Hadi, Safa K. Hachim +3

    Maqola20224 iqtibos
    ABI

  13. A DFT study on AlN nanotubes and nanosheets as anodes for Mg-ion batteries

    Tiantian Mei, Jianbao Wu, Shuhan Lu +4

    Maqola20213 iqtibos
    ABI

  14. Potential use of silicon carbide monolayer as an anode in rechargeable Mg-ion batteries

    Mustafa M. Kadhim, Taleeb Zedan Taban, Sallal A.H. Abdullaha +3

    Maqola20233 iqtibos
    ABI

  15. The feasibility of BeP2 monolayer as an anode material for Mg-ion batteries: A density functional theory study

    Manal A. Abbood, Yehya M. Ahmed, Subhash Chandra +5

    Maqola20233 iqtibos
    ABI

  16. Prediction of chemically ordered dual transition metal carbides (MXenes) as high-capacity anode materials for Na-ion batteries

    Na Li, Yiran Li, Jun Fan

    Maqola20212 iqtibos
    ABI

  17. Potassium-ion batteries: outlook on present and future technologies

    Xin Min, Jun Xiao, Minghao Fang +7

    Maqola20212 iqtibos
    ABI

  18. Critically assessing sodium-ion technology roadmaps and scenarios for techno-economic competitiveness against lithium-ion batteries

    Adrian Yao, Sally M. Benson, William C. Chueh

    Maqola20252 iqtibos
    ABI

  19. Density functional theory calculations for evaluation of phosphorene as a potential anode material for magnesium batteries

    Xinpeng Han, Cheng Liu, Jie Sun +2

    Maqola20182 iqtibos
    ABI

  20. Graphyne as an anode material for Mg-ion batteries: A computational study

    Yingling Mao, Hamed Soleymanabadi

    Maqola20202 iqtibos
    ABI

  21. Borophene as a promising anode material for sodium-ion batteries with high capacity and high rate capability using DFT

    Jianhua Liu, Cheng Zhang, Lei Xu +1

    Maqola20182 iqtibos
    ABI

  22. Silicon/Carbon Composite Anode Materials for Lithium-Ion Batteries

    Fei Dou, Liyi Shi, Guorong Chen +1

    Maqola20192 iqtibos
    ABI

  23. Large-Scale Benchmark of Exchange–Correlation Functionals for the Determination of Electronic Band Gaps of Solids

    Pedro Borlido, T. Aull, Ahmad W. Huran +3

    Maqola20192 iqtibos
    ABI

  24. Two-dimensional tetragonal transition-metal carbide anodes for non-lithium-ion batteries

    Changcheng Ke, Dong Fan, Chengke Chen +3

    Maqola20202 iqtibos
    ABI

  25. Current status and future directions of multivalent metal-ion batteries

    Yanliang Liang, Hui Dong, Doron Aurbach +1

    Maqola20202 iqtibos
    ABI