Spin-finder
Are you working with aromatic polycyclic hydrocarbons and concerned about their ground state spin? This repository demonstrates how to calculate the spin multiplicity (2S+1) of large PAH using our own algorithm based on Ovchinnikov's rule.
Spin finder requires the installation of the following libraries:
1 maintainer
Release files for spinfinder 0.0.3
For a detailed explanation of source distributions (sdists) and built distributions (wheels), please see the package formats documentation.
Source distribution (sdist)
| File | Size | Uploaded | |
|---|---|---|---|
| spinfinder-0.0.3.tar.gz | 3.3 kB | Details |
Built distribution (wheel)
| File | Interpreter | ABI | Platform | Reset |
|---|---|---|---|---|
| spinfinder-0.0.3-py3-none-any.whl | Python 3 | none | any | Details |
Total release size: 8.4 kB
Release files / spinfinder-0.0.3.tar.gz
| Download URL | spinfinder-0.0.3.tar.gz |
|---|---|
| Size | 3.3 kB |
| Tags | Source |
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SHA-256 checksum How to use checksums |
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Uploaded using Trusted Publishing? What is trusted publishing? |
No |
| Uploaded via |
twine/4.0.2 CPython/3.9.7
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Release files / spinfinder-0.0.3-py3-none-any.whl
| Download URL | spinfinder-0.0.3-py3-none-any.whl |
|---|---|
| Size | 5.0 kB |
| Tags | Python 3 |
|
SHA-256 checksum How to use checksums |
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BLAKE2b-256 checksum How to use checksums |
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Uploaded using Trusted Publishing? What is trusted publishing? |
No |
| Uploaded via |
twine/4.0.2 CPython/3.9.7
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