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Hi,
I've been trying to calculate the energies of monoatomic compounds. All of the atoms ran successfully, except for hydrogen with multiplicity 2.
My in-file:
```
molecule mol_atomic_hydrogen…
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### Information
- **Qiskit Aqua version**: 0.7.3
- **Python version**: 3.7.7
- **Operating system**: MacOS Catalina, Version 10.15.5, Macbook Pro, 13 inch, 16GB
### What is the current b…
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There are some interesting algorithms in simulation from Physics, Chemistry, and Engineering especially regarding Monte Carlo simulation: Heat Bath algorithm, Metro-Police algorithm, Markov Chain Mont…
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Hi,
It is sometimes necessary in my field to abbreviate journal titles. For instance,
**THE JOURNAL OF PHYSICAL CHEMISTRY C**
becomes
**J PHYS CHEM C**
Is it at the moment possible with…
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Since we are also working on extending the `ffxml` format in #1168, now is a good time to also discuss extensions of the `ffxml` format to deal with multiple protonation/tautomeric states for constant…
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I apologize for opening an issue for this, but I'm really stuck and I can't get ahead..
I can insert bibliography links with org-ref-insert -link, but when hitting 'return' with the point on a link …
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Hello,
I am trying to write a time-implicit and sub-cycle cooling solver in the problem generator. Following the instruction in the wiki, it recommends the user to write the solver in the `MeshB…
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This is a child issue of #161.
We need a sound for the amount of light produced by the lightbulb, which corresponds to the amount of current being generated by moving the magnet. A prototype that …
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@dimasciput @timlinux
At the moment there is no way for us to add or update the Study Reference Details, such as adding a DOI, or URL, or uploading a pdf for a study that already exists in FBIS, and…
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Hi @leonardiwagner, i'm still working on the accomplishments however the behaviour of the deployment of its subsections seems to be quite different from other sections. Actually that's what I'm able t…