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arXiv 1401.0576cond-mat.mes-hallcond-mat.mtrl-sci
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MoS2纳米谐振器:内在性能优于石墨烯?

MoS2 Nanoresonators: Intrinsically Better Than Graphene?

Jin-Wu Jiang, Harold S. Park, Timon Rabczuk

摘要:

我们进行经典的分子动力学模拟,以检查在单层的MoS $_{2}$纳米谐振器的固有能量耗散,其中一个重点是比较其耗散特性与单层石墨烯。我们的关键发现是,与石墨烯相比,MoS $_{2}$纳米谐振器表现出显著更低的能量耗散,因此在室温以下至少四倍的更高的质量(Q)因子。此外,这种高Q因子赋予MoS $_{2}$纳米谐振器更高的品质因数,定义为频率乘以Q因子,尽管对于相同尺寸,谐振频率比石墨烯小$50%$。通过利用从声子-声子散射理论的参数,我们表明,这种减少的能量耗散是由大的能隙中的声子色散的MoS $_{2}$,它分离的声学声子分支的光学声子分支,导致一个保存机制的MoS $_{2}$纳米谐振器的谐振振荡。我们进一步研究了拉伸机械应变和非线性致动对Q因子的影响,其中拉伸应变被发现抵消了较高致动振幅下Q因子的降低。总体而言,我们的模拟说明了潜在的效用的MoS $_{2}$的高频传感和驱动应用。

英文摘要:

We perform classical molecular dynamics simulations to examine the intrinsic energy dissipation in single-layer MoS$_{2}$ nanoresonators, where a point of emphasis is to compare its dissipation characteristics with those of single-layer graphene. Our key finding is that MoS$_{2}$ nanoresonators exhibit significantly lower energy dissipation, and thus higher quality (Q)-factors by at least a factor of four below room temperature, than graphene. Furthermore, this high Q-factor endows MoS$_{2}$ nanoresonators with a higher figure of merit, defined as frequency times Q-factor, despite a resonant frequency that is $50%$ smaller than graphene for the same size. By utilizing arguments from phonon-phonon scattering theory, we show that this reduced energy dissipation is enabled by the large energy gap in the phonon dispersion of MoS$_{2}$, which separates the acoustic phonon branches from the optical phonon branches, leading to a preserving mechanism for the resonant oscillation of MoS$_{2}$ nanoresonators. We further investigate the effects of tensile mechanical strain and nonlinear actuation on the Q-factors, where the tensile strain is found to counteract the reductions in Q-factor that occur with higher actuation amplitudes. Overall, our simulations illustrate the potential utility of MoS$_{2}$ for high frequency sensing and actuation applications.

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