Study on the Adsorption Characteristics of Mo-Doped Graphene on the Decomposition Products of SF<sub>6</sub> Substitute Gas Based on First-Principle Calculations

<table class="table-group" id="tab4"><tr><td><table class="table"><tr><td class="thead-hr" colspan="2"><hr/></td></tr><tr class="thead"><td class="align_left">Models</td><td class="align_center">Transfer charge (△<i>Q</i>)</td></tr><tr><td class="thead-hr" colspan="2"><hr/></td></tr><tr><td class="align_left">Graphene/(H<sub>2</sub>S)</td><td class="align_center">+0.010</td></tr><tr><td class="align_left">Mo- Graphene/(H<sub>2</sub>S)</td><td class="align_center">+1.348</td></tr><tr><td class="align_left">Graphene/(SO<sub>2</sub>)</td><td class="align_center">−0.011</td></tr><tr><td class="align_left">Mo- Graphene/(SO<sub>2</sub>)</td><td class="align_center">−0.345</td></tr><tr><td class="align_left">Graphene/(CF<sub>4</sub>)</td><td class="align_center">−0.013</td></tr><tr><td class="align_left">Mo- Graphene/(CF<sub>4</sub>)</td><td class="align_center">−0.215</td></tr><tr><td class="align_left">Graphene/(SO<sub>2</sub>F<sub>2</sub>)</td><td class="align_center">−0.004</td></tr><tr><td class="align_left">Mo- Graphene/(SO<sub>2</sub>F<sub>2</sub>)</td><td class="align_center">−0.952</td></tr><tr class="table-tr"><td colspan="2"><hr class="tbody-hr"/></td></tr></table></td></tr></table>

<div>Transfer charge of gas molecules on the surface of intrinsic graphene and Mo-doped intrinsic graphene.</div>

Advances in Condensed Matter Physics

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Table 4

Table 4: Study on the Adsorption Characteristics of Mo-Doped Graphene on the Decomposition Products of SF<sub>6</sub> Substitute Gas Based on First-Principle Calculations 

Table 4 | Study on the Adsorption Characteristics of Mo-Doped Graphene on the Decomposition Products of SF6 Substitute Gas Based on First-Principle Calculations 