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We are facing an error regarding Optimisation Part 2
Applying fix for Apple Silicon
Applying fix for Apple Silicon
City Energy Analyst version 3.38.0
Running cea optimization-new with the fol…
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The current implementation of the Home Assistant Solcast PV Solar Forecast Integration is not providing sufficiently accurate predictions for solar energy production.
This inaccuracy hampers the e…
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![779ff07428a278b33235d229a00fc4f](https://github.com/user-attachments/assets/ee5816e4-82a5-4f13-bfb4-925e2709dd46)
![0e12548c9d28a4d28110e8bc63e5f58](https://github.com/user-attachments/assets/d21e9…
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**Submitting author:** @samgdotson (Samuel Dotson)
**Repository:** https://github.com/arfc/osier
**Branch with paper.md** (empty if default branch): joss
**Version:** v0.3.0
**Editor:** @prashjha
**Re…
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**Describe the bug**
For organic molecules with -NO2 groups, conformer generation and UFF optimization will produce one conformer with O-N-O angle being 0 degree (and two O almost overlapping). And t…
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Hi,
First of all, thank you for the excellent work on the wattpilot-ha integration! I have a feature suggestion that I believe could be beneficial for users who are particularly focused on optimizi…
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Currently the PhAlkEthOh dataset comes from the OpenFF optimization dataset and contains the entire optimization trajectory for each unique molecule.
It would be good to have a few additional vari…
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I like the API for qcop and would love to use it as a common interface for energy, hessian, and structure calculations with [Sella](https://github.com/zadorlab/sella)/ASE, similar to the current geome…
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This issue is to discuss some possible improvements for Jastrow radial-cutoff default values. Particularly, in Nexus, J12 defaults to the largest radial cutoff allowed by the supercell in periodic bou…
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**Submitting author:** @JeanWi (Jan F. Wiegner)
**Repository:** https://github.com/UU-ER/AdOpT-NET0
**Branch with paper.md** (empty if default branch): joss-submission
**Version:** v0.1.2
**Editor:** …