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@@ -82,18 +82,58 @@ In this paper, we do some things. We do something for the first time.
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= Results and Discussion
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// 拉曼活性的声子模式对应于 Gamma 点附近的声子模式。
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// 根据这些声子模式在拉曼实验中的表现,我们将这些声子分成三个部分。
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== Phonons in Perfect 4H-SiC
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// 拉曼活性的声子模式对应于 Gamma 点附近的声子模式。
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// 根据这些声子模式的极性,我们将这些声子分成两类。
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Raman scattering peeks correspond to phonons located near the $Gamma$ point in reciprocal space.
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We classified these phonons into two categories based on their polarities:
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(i) negligible-polar phonons (i.e., phonons with no polarity or very weak polarity),
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whose dispersion curves are continuous near the Γ point (as shown in @phonon),
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and for which the effect of polarity can be ignored in the Raman scattering process;
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and (ii) strong-polar phonons,
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whose dispersion curves exhibit discontinuity near the Γ point (also shown in @phonon),
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where the polarity gives rise to observable effects in the Raman spectra.
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#figure(
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image("/画图/声子不连续/整体图.svg", width: 80%),
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caption: [Weak- and None-polarized phonons near $Gamma$ point],
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placement: none
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)<phonon>
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=== Phonons with Negligible Polarities
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// 我们使用 Gamma 点的声子模式来近似拉曼过程中的非极性声子。
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// 这个近似被广泛使用,并且由于这个原因而被认为是可行的:
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// 尽管拉曼过程中起作用的声子并不是那些严格在 Gamma 点的,
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// 但这些声子模式的散射谱在 Gamma 附近连续且导数为零,且波矢很小(在本文中大约 0.01 A,只有c轴的大约2%)。
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// 因此,它们的性质与 Gamma 点的声子模式区别不大。
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Phonons at the $Gamma$ point were used
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to approximate negligible-polar phonons that participating in Raman processes.
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This approximation is widely adopted and justified by the fact that,
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although the phonons participating in Raman processes are not these strictly located at the $Gamma$ point,
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their dispersion near the $Gamma$ point is continuous with vanishing derivatives,
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and their wavevector is very small
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(about 0.01 AA in this paper, which corresponds to only 2% of the smallest reciprocal lattice vector of 4H-SiC).
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// TODO: 确认这个数值
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Therefore, negligible-polar phonons involved in Raman processes
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have nearly indistinguishable properties from those at the $Gamma$ point.
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// 4H-SiC 在 Gamma 有 21 个distinct phonons,其中极性较弱的有 18 个。这些模式对应于点群 $\mathrm{C_{6v}}$ 的 12 个表示($\mathrm{3A_1+4B_1+3E_1+4E_2}$。
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// 对于非极性声子的拉曼散射,我们将使用 Gamma 点的声子模式来近似描述。
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// 这是因为,尽管拉曼实验中,起作用的声子并不严格在 Gamma 点;但这些声子模式的散射谱在 Gamma 附近是连续且导数为零,且起作用的声子离开 Gamma 点的距离也很小(对于 532 nm 的激光,离开 Gamma 点的距离小于 0.01 Å),它们的性质与 Gamma 点的声子模式区别不大。
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//
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//
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// 不同方向入射/散射光的拉曼实验对应于 Gamma 附近、偏向于不同方向的声子。
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// 其中 $\mathrm{A_1}$、$\mathrm{B_1}$ 为一维表示,对应于无简并的声子;$\mathrm{E_1}$、$\mathrm{E_2}$ 为二维表示,对应于二重简并的声子。
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// 在拉曼实验中,起作用的声子并不严格在 Gamma 点;但大多数声子的色散谱在 Gamma 点连续且导数(斜率)为零,因此大多情况下可以沿用这个分类,少数情况我们稍后会专门讨论。
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// 4H-SiC 在 Gamma 点的声子共有 21 个模式,这些模式对应于点群 $\mathrm{C_{6v}}$ 的 14 个表示($\mathrm{3A_1+4B_1+3E_1+4E_2}$,其中 $\mathrm{A_1}$、$\mathrm{B_1}$ 为一维表示,对应于无简并的声子;$\mathrm{E_1}$、$\mathrm{E_2}$ 为二维表示,对应于二重简并的声子)。在拉曼实验中,起作用的声子并不严格在 Gamma 点;但大多数声子的色散谱在 Gamma 点连续且导数(斜率)为零,因此大多情况下可以沿用这个分类,少数情况我们稍后会专门讨论。
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Raman scattering peeks correspond to phonons located near $Gamma$ point in reciprocal space.
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We classified these phonons into three categories according to their behavior in Raman scattering:
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(1) phonons could not be observed in Raman scattering spectrum,
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either because they are Raman inactive or their scattering intensity is too weak;
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(2) phonons could be observed in Raman scattering spectrum and with weak or no polarities,
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their frequencies were independent of the direction of the incident light;
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(3) strong polar phonons,
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which were visible in Raman scattering spectrum,
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and their frequencies depend on the direction of the incident light.
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// 我们计算了 4H-SiC 在 A-Gamma 和 Gamma-M 上的声子频率,如图和附录1所示。
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// 在拉曼散射中,起作用的模式都是那些非常接近于 Gamma 的模式
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