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Update README, orbitals

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This commit is contained in:
Edgar P. Burkhart 2022-07-06 08:20:21 +02:00
parent c5e2478b91
commit d3358fa40d
Signed by: edpibu
GPG key ID: 9833D3C5A25BD227
3 changed files with 44 additions and 100 deletions
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6
data/processing/orbitals.py
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@ -22,8 +22,6 @@ config.read(args.config)
inp_root = pathlib.Path(config.get("inp", "root"))
out_root = pathlib.Path(config.get("out", "root"))
out_ts = out_root.joinpath("ts.dat")
raw_ts = []
for tsi in config.get("inp", "raw_ts").split(","):
raw_ts.append(
@ -98,7 +96,7 @@ ax2dv.grid(c="k", alpha=.2)
ax2dv.set(aspect="equal", xlabel="x (m)", ylabel="z (m)")
ax2dv.set(ylim=(-10, 10))
ax2dv.yaxis.set_minor_locator(MultipleLocator(1))
fig2dv.savefig("out_orbitals.pdf")
fig2dv.savefig("out_orbitals.jpg")
fig2dv.savefig(out_root.joinpath("orbitals.pdf"))
fig2dv.savefig(out_root.joinpath("out_orbitals.jpg"))
plt.show()