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2025-07-04 12:01:42 +08:00
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@@ -13,23 +13,22 @@ This approximation is based on the fact that
18 个声子属于 12 个表示。拉曼张量的形状可以确定,大小不能。
这些声子的拉曼张量的形状可以通过对称性分析来确定。
Gamma 点声子满足 C#sub[6v] 点群对称性18 个模式包含了 2A#sub[1] + 4B#sub[1] + 2E#sub[1] + 4E#sub[2] 12 个表示;
中简并表示E1 E2的拉曼张量的形状可以通过进一步考虑 C#sub[2v] 点群中的表示确定,如表所示。
18 Gamma 点的弱极性声子包含了 C#sub[6v] 点群的12 个不可约表示(2A#sub[1] + 4B#sub[1] + 2E#sub[1] + 4E#sub[2])。
通过进一步考虑 C#sub[6v] 中简并表示E1 E2 C#sub[2v] 中的表示,所有声子的拉曼张量的非零分量可以确定,如表所示。
其中B#sub[1] 模式具有零拉曼张量,不参与拉曼散射;
其它表示的模式具有非零拉曼张量分量,可能可以在适当的偏振配置下在拉曼实验中观察到。
然而,模式是否足够强以在实验中可见取决于其拉曼张量分量的大小,而仅通过对称性分析无法确定这些大小。
// Representation of these 18 phonons, and the shape of their Raman tensors could be determined in advance.)
Phonons at the #sym.Gamma point satisfy the C#sub[6v] point group symmetry,
and the 18 negligible-polar phonons correspond to 12 irreducible representations of the C#sub[6v] point group:
2A#sub[1] + 4B#sub[1] + 2E#sub[1] + 4E#sub[2].
Phonons belonging to the A#sub[1] and B#sub[1] representations vibrate along the z-axis and are non-degenerate,
while those belonging to the E#sub[1] and E#sub[2] representations vibrate in-plane and are doubly degenerate.
Phonons of the B#sub[1] representation are Raman-inactive, as their Raman tensors vanish.
In contrast, phonons of the other representations are Raman-active,
and the non-zero components of their Raman tensor
can be determined by further considering their representation in the C#sub[2v] point group (see @table-rep).
These Raman-active phonons are potentially be visible in Raman experiment under appropriate polarization configurations.
The form of the Raman tensors (i.e., which components are non-zero) could be determined by symmetry analysis.
The 18 negligible-polar phonons at the #sym.Gamma point
correspond to twelve irreducible representations of the C#sub[6v] point group
(2A#sub[1] + 4B#sub[1] + 2E#sub[1] + 4E#sub[2]).
By further considering the doubly degenerate modes of the C#sub[6v] (E#sub[1] and E#sub[2])
in the C#sub[2v] point group,
the form of the 18 negligible-polar phonons' Raman tensors can be determined, as shown in @table-rep.
Phonons of the B#sub[1] representation in C#sub[6v] have a zero Raman tensor and do not contribute to Raman scattering,
while other phonons have non-zero Raman tensor components,
indicating they may be observable in Raman experiments under appropriate incidence and polarization configurations.
However, whether a mode is sufficiently strong to be experimentally visible
depends on the magnitudes of its Raman tensor components,
which cannot be determined solely from symmetry analysis.

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@@ -16,6 +16,7 @@
- [x] 英文
- [x] 调整语言
- [ ] 坐标轴定义
- [ ] 偏振
- [x] 模型总述
- [x] 无缺陷和点缺陷的模型大小、结构
- [x] 中文
@@ -48,9 +49,9 @@
- [x] 中文
- [x] 英文
- [x] 调整语言
- [ ] 表示
- [ ] 中文
- [ ] 英文
- [/] 表示
- [x] 中文
- [x] 英文
- [ ] 调整语言
- [ ] 估算拉曼张量
- [ ] 中文