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Got this one [filed on UserVoice](https://windowsserver.uservoice.com/forums/301869-powershell/suggestions/11454600-bug-nullable-enum-dsc-property-throws-system-n) and discussed it again at PS Summit …
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I have started using Powershell 7.1.0-preview.1 to compile DSC configurations into mofs on Linux and have noticed a potential memory leak when invoking a configuration block.
# Steps to reproduce
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### Description:
Dear author, I tried to install ChatMOF on my machine, but the installation failed during the `pip install -e .` step.
### Steps to Reproduce:
1. `$ git clone https://github.com/…
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Hi, I am having some issues with training the model using multiple cpu nodes to accelerate the process. I am following the documentation as I am new to MOFTransformer and am working on training step. …
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Hi, I wanted to follow up on some issues I have been having on trying to predict bandgap values using predict.py. I placed the cifs i wanted to predict bandgap value in root dir and ran prepare_data w…
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Penghua wants to have this explicit dispersion term.
Either let the user to input C parameters or let the powerful SNES to optimize them.
We will study if NEP-C/r^6 will output pure NEP.
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Sometimes I can create a MOF and there is nothing wrong with it. By this I mean that the building blocks have the correct number of connections points, and the correct geometry, for the topology. Buil…
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Hi, how to process case of MOF_data with the process.py. At the line 7, mofs = ase.io.read('opt-geometries.xyz',index=':'), but what is opt-geometries.xyz? There is no this file in the qmof_database.
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I noticed these broken links as I was moving website content to the new repository:
https://github.com/GOMC-WSU/gomc-wsu.github.io/blob/c7dbe2b1d80c58326e671dcb28c05769f257fc09/publications.html#L…
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Hi, how to process the MOF_data to get the file of opt-geometries.xyz?
Thank you.