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36 ta ish

Ish: Pd and Pt transition metal decorated WS2 nanosheets as efficient gas sensors for SOx molecules: A comparative DFT study

  1. Special points for Brillouin-zone integrations

    Hendrik J. Monkhorst, J.D. Pack

    Maqola197660 iqtibos
    ABI

  2. Self-Consistent Equations Including Exchange and Correlation Effects

    W. Kohn, L. J. Sham

    Maqola196544 iqtibos
    ABI

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

    Stefan Grimme

    Maqola200642 iqtibos
    ABI

  4. Sarlavhasiz

    Boshqa39 iqtibos
    ABI

  5. The SIESTA method for<i>ab initio</i>order-<i>N</i>materials simulation

    José M. Soler, Emilio Artacho, Julian D. Gale +4

    Maqola200217 iqtibos
    ABI

  6. Generalized Gradient Approximation Made Simple [Phys. Rev. Lett. 77, 3865 (1996)]

    John P. Perdew, Kieron Burke, Matthias Ernzerhof

    Maqola199714 iqtibos
    ABI

  7. Single-layer MoS2 transistors

    Branimir Radisavljevic, Aleksandra Rađenović, Jacopo Brivio +2

    Maqola20118 iqtibos
    ABI

  8. Ultrasensitive photodetectors based on monolayer MoS2

    Oriol Lopez-Sanchez, Dominik Lembke, Metin Kayci +2

    Maqola20138 iqtibos
    ABI

  9. Pd-doped MoS2 monolayer: A promising candidate for DGA in transformer oil based on DFT method

    Hao Cui, Xiaoxing Zhang, Guozhi Zhang +1

    Maqola20187 iqtibos
    ABI

  10. A first-principles study of SOF2 and SO2F2 adsorption onto PdSe2-based monolayers: Favorable sensitivity and selectivity by doping single Cu or Rh atom

    Hao Cui, Jian Hu, Xiaoping Jiang +1

    Maqola20257 iqtibos
    ABI

  11. Noble metal (Pd, Pt)-functionalized WSe2 monolayer for adsorbing and sensing thermal runaway gases in LIBs: A first-principles investigation

    Hao Cui, Hailong Wu, Dan He +1

    Maqola20256 iqtibos
    ABI

  12. Single Ni atom doped WS2 monolayer as sensing substrate for dissolved gases in transformer oil: A first-principles study

    Dachang Chen, Yi Li, Song Xiao +3

    Maqola20214 iqtibos
    ABI

  13. Adsorption for SO2 gas molecules on B, N, P and Al doped MoS2: The DFT study

    Ruiyang Zhang, Da Fu, Jiaming Ni +2

    Maqola20183 iqtibos
    ABI

  14. Adsorption of gas molecule on Rh, Ru doped monolayer MoS2 for gas sensing applications: A DFT study

    Ruijuan Du, Wei Wu

    Maqola20213 iqtibos
    ABI

  15. Improving gas sensing properties of graphene by introducing dopants and defects: a first-principles study

    Yonghui Zhang, Ya-Bin Chen, Kai‐Ge Zhou +4

    Maqola20093 iqtibos
    ABI

  16. First-principles design of noble metal (Rh and Pd) dispersed Janus WSTe monolayer for toxic gas sensing applications

    Hao Cui, Mingxin Ran, Xiaoyan Peng +1

    Maqola20243 iqtibos
    ABI

  17. Design of Dual-Modified MoS<sub>2</sub> with Nanoporous Ni and Graphene as Efficient Catalysts for the Hydrogen Evolution Reaction

    Li Xin Chen, Zhiwen Chen, Yu Wang +2

    Maqola20182 iqtibos
    ABI

  18. Two-Dimensional NbS<sub>2</sub> Gas Sensors for Selective and Reversible NO<sub>2</sub> Detection at Room Temperature

    Yeonhoo Kim, Ki Chang Kwon, Sungwoo Kang +8

    Maqola20192 iqtibos
    ABI

  19. Edge-exposed MoS2 nanospheres assembled with SnS2 nanosheet to boost NO2 gas sensing at room temperature

    Lujia Liu, Muhammad Ikram, Laifeng Ma +6

    Maqola20202 iqtibos
    ABI

  20. Growth Control of WS<sub>2</sub>: From 2D Layer by Layer to 3D Vertical Standing Nanowalls

    Yusuf Koçak, Emre Gür

    Maqola20202 iqtibos
    ABI

  21. Emerging van der Waals junctions based on TMDs materials for advanced gas sensors

    Wei Zheng, Xianghong Liu, Jiayue Xie +2

    Maqola20212 iqtibos
    ABI

  22. Y-decorated MoS2 monolayer for promising hydrogen storage: A DFT study

    Hongying Liu, Shulin Yang, Gu Lei +6

    Maqola20222 iqtibos
    ABI

  23. An active MoS2 with Pt-doping and sulfur vacancy for strengthen CO2 adsorption and fast Capture: A DFT approach

    Yue Du, Shaofen Zhao, Haodong Tang +2

    Maqola20222 iqtibos
    ABI

  24. Adsorption of toxic gases by Janus MoSeTe monolayers doped with transition metals and surface defects: A first-principles study

    Chaowen Xue, Long Lin, Kun Xie +2

    Maqola20242 iqtibos
    ABI

  25. Single-Layer MoS<sub>2</sub>Phototransistors

    Zongyou Yin, Hai Li, Hong Li +7

    Maqola20112 iqtibos
    ABI