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Federica may check if we can not link directly into vibroscopy with our single point (#2) and optimisation (#3) already once they are done
- [x] #39
- [x] #40
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- [x] boundary atoms do not move in phonon
- [x] make it more smooth, inside one second more frame, allow the user to control it.
```javascript
// control the speed of the animation
ed…
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Hi everyone,
I want to obtain the lifetime of each phonon mode. When I tried to obtain the quasiparticle phonon data by running:
$ dynaphopy input_file TRAJECTORY -sdata
there was an error:
>…
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Hello, I hit an issue with phonon-mpv playing videos in Gwenview (version 24.05.2, running plasma 6, phonon for qt6 etc.).
The issue occurs when I switch from one video to another – that is, when I…
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![image](https://github.com/user-attachments/assets/438e885e-9c0f-4714-ae1e-48457bbadf6f)
I _imagine_ (hehe) this can be done by treating the imaginary frequencies as negative as in the plot.
So…
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The experimentalis are interest to have different projections for the phonon pdos.
For example to select some atoms, and obtained the contribution of those atoms in pdos
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**Original reporter:** Pablo Gila-Herranz (Via Error Reporter)
**Describe the bug**
Seems like the AbINS program does not properly identify deuterium species for CASTEP phonon calculations, …
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Would it be possible to calculate exciton-phonon coupling in pyscf?
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Dear kbspooner, I wonder how to plot the frequency-depencent phonon spectral function of single phonon mode, like this, can you give me some suggestions?
![b3995b528c6e2fe3f5561d335f662a4](https://g…
DFT13 updated
4 months ago
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@naik-aakash pointed out that we might think about a better way to store and access the xyz files (train.xyz, train_wo_sigma.xyz, train_phonon.xyz etc.)