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### simulating periodic systems or slab with qiskit and pyscf
Hi!
I am wondering how can I simulate periodic systems using qiskit-nature-pyscf such as a slab of Si for example
I came across the…
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Hello,
Thank you for your implementation of MLFMM.
Unfortunately, for high frequencies, the simulations fail to converge.
I try to modify the NC.inp as Brinkmann does, but it doesn't work for me.…
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Currently, we only fit a single background component. The basic code is relatively stragithforward, we just need to add more nuisance parameters. The hard part though is to make it converge.
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Payu's handling of the cice calendar is a bit confusing, especially around leap years. It would be good to clarify how the calendar is controlled, and whether we should make any changes. I'll note do…
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### Your name
Longtao Wu
### Your affiliation
JPL
### Please provide a clear and concise description of your question or discussion topic.
I have some questions about using GCHP 14.4.0 as follows…
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When running full tests this week, I noticed that virtually no lift was being generated by the wing. When I went and zoomed into the simulator, the wings were vibrating at high frequency, probably the…
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When looking at the section "Residuals across all simulations" generated with the Reporting engine version 2.2, I have the following remarks:
- The use of capital letters in axis labels is not stan…
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See this build for example: https://buildkite.com/clima/climaatmos-gpulongruns/builds/210#_. Most of the longrun simulations break with Float64.
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i have carried out the MC simulations at temperature of 5 K, i am getting the results.json file as:
```
{
"" : [ 0.371831216496, 0.500000000000, 0.500000000000, 0.500000000000, 0.575350322421,…
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According to the README.md, one can define and set up the various "soft LJ potentials" in a file called `LJsoft_RSQ.table` using the script `setup_ljsoft_potentials.py`. User should be able to modify …