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Dear Developer,
I hope this email finds you well.
I am writing to you today to inquire about compiling the GPU version of ShengBTE. I have two questions:
Could you please provide the arch.mak…
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Dear developer,
Can you share this code or give me an idea about file conversion?I'm not sure what pair1 and pair2 refer to in the alamode xml file.
Looking for your reply!
Yours,
Lamed
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### Describe the Testing Issue
Currently, some software already supports post-processing of ABACUS. In the development process of ABACUS, we need some automated testing to detect whether these inte…
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- [ ] Job submission
- [ ] Post processing
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Hi, Dr Zhou.
I read a series of your work about CSLD. I have tried to complete simulation on Si, NaCl and some crystals with tetragonal structure, and I got expected phonon dispersion, which matche…
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Dear developer,
I compiled the latest alamode, but I got an error:
```
make: Warning: File `writer.cpp' has modification time 35371 s in the future
icpc -O2 -xHOST -qopenmp -std=c++11 -I../inclu…
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Dear Professor,
I want to convert phono3py's generated force constants into ShengBTE inputs, I saw an issue there you have provided a git link to do that, but that link is no longer working. Can yo…
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I use phonon scattering data from five 2D materials. The GiftBTE cannot work.
terminate called after throwing an instance of 'std::invalid_argument'
what(): stod
APPLICATION TERMINATED WITH THE …
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Hi, thank you all so much for the previous help. I have managed to install the TDEP code in my workstation and used it to explore the system I want. I had got a decent dispersions and working on getti…
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hello! i get an error when i run——python diffcsp/run.py data=perov_5 expname=reproduction_diffcsp_perov
diffcsp/run.py:172: UserWarning:
The version_base parameter is not specified.
Please spe…