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The binary installer for Linux linked on the main website fails when installing the pymatgen and wxpython packages. As a consequence, the binary files for larch and related programs are not created.
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I am attempting run a frequency calculation with Psi4 (version 1.5) and Python 3.7.10. All other calculations (optimization, single point energy, etc.) work well. However, when I attempt to run a freq…
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### 路由地址
```routes
/acs/journal/:id
```
### 完整路由地址
```fullroutes
/acs/journal/accacs
/acs/journal/jacsat
```
### 相关文档
https://docs.rsshub.app/journal.html#american-chemistry-so…
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Currently, in [Q4_0](https://github.com/ggerganov/ggml/pull/27) quantization we choose the scaling factor for each 32 group of weights as `abs(max(x_i))/7`. It is easy to see that this is suboptimal.
…
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BPO | [32195](https://bugs.python.org/issue32195)
--- | :---
Nosy | @ronaldoussoren, @abalkin, @ned-deily, @serhiy-storchaka, @davechallis
Superseder | bpo-13305: datetime.strftime("%Y") not…
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By the help of `SpaceGroupIrep`, I try to understand the blog [here](https://blog.sciencenet.cn/blog-1502061-1201748.html), titled "石墨烯Dirac点的群论解释", as shown below:
.
Also for …
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This is a cont'd discussion based on the results generated by `getBCsymmetry.py` tool [here](https://github.com/goodluck1982/SpaceGroupIrep/issues/1#issuecomment-1019803052), as denoted by the followi…
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We'd like to be able to create a mapfile for voms authentication such that we can choose the mappings between FQANs and Unix users; this is needed for multiuser to work. VOMS mapfiles are made of line…
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## 🐛 Bug Report
`toEqual` is not symmetric for `Set`:
```js
const s1 = new Set([false, true]);
const s2 = new Set([new Boolean(true), new Boolean(true)]);
expect(s1).not.toEqual(s2); //…