ionic-conductivity-step 2026.10.17__py2.py3-none-any.whl

ionic_conductivity_step/__init__.py

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+# -*- coding: utf-8 -*-
+
+"""
+ionic_conductivity_step
+A SEAMM plug-in for Ionic Conductivity
+"""
+
+# Bring up the classes so that they appear to be directly in
+# the ionic_conductivity_step package.
+
+from .ionic_conductivity import IonicConductivity  # noqa: F401, E501
+from .ionic_conductivity_parameters import IonicConductivityParameters  # noqa: F401
+from .ionic_conductivity_step import IonicConductivityStep  # noqa: F401, E501
+from .tk_ionic_conductivity import TkIonicConductivity  # noqa: F401, E501
+
+from .metadata import metadata  # noqa: F401
+
+# Handle versioneer
+from ._version import get_versions
+
+__author__ = "Paul Saxe"
+__email__ = "psaxe@molssi.org"
+versions = get_versions()
+__version__ = versions["version"]
+__git_revision__ = versions["full-revisionid"]
+del get_versions, versions

ionic_conductivity_step/_version.py

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+
+# This file was generated by 'versioneer.py' (0.18) from
+# revision-control system data, or from the parent directory name of an
+# unpacked source archive. Distribution tarballs contain a pre-generated copy
+# of this file.
+
+import json
+
+version_json = '''
+{
+ "date": "2026-10-17T09:39:13-0400",
+ "dirty": false,
+ "error": null,
+ "full-revisionid": "978ab77380ce7daa9c34350376cccfcec2d1e3f0",
+ "version": "2026.10.17"
+}
+'''  # END VERSION_JSON
+
+
+def get_versions():
+    return json.loads(version_json)

ionic_conductivity_step/data/properties.csv

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+Property,Type,Units,Description,URL
+ionic conductivity#Einstein-Helfand#{model},float,S/m,"The ionic conductivity from the collective displacement of the charges using {model}",https://en.wikipedia.org/wiki/Conductivity_(electrolytic)
+"ionic conductivity,stderr#Einstein-Helfand#{model}",float,S/m,"The standard error of the ionic conductivity using {model}",https://en.wikipedia.org/wiki/Conductivity_(electrolytic)
+ionic conductivity#Nernst-Einstein#{model},float,S/m,"The Nernst-Einstein ionic conductivity using {model}",https://en.wikipedia.org/wiki/Nernst%E2%80%93Einstein_equation
+ionicity#Ionic Conductivity#{model},float,,"The ratio of the Einstein-Helfand and Nernst-Einstein conductivities using {model}",https://en.wikipedia.org/wiki/Conductivity_(electrolytic)

ionic_conductivity_step/data/references.bib

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+This is an initial library of BibTex references for the ionic_conductivity_step plug-in for SEAMM,
+generated automatically by the cookiecutter. You may wish to edit the first entry to correct some
+of the information.
+
+Add other references to the end of the file and add code in the plug-in to cite the references as
+appropriate. This is done with code like this:
+
+        self.references.cite(
+            raw=self._bibliography['doi:10.1002/jcc.21224'],
+            alias='packmol',
+            module='packmol_step',
+            level=1,
+            note='The principle PACKMOL citation.'
+        )
+
+which is typically in the run() method of the plug-in.
+
+The base node class in SEAMM automatically reads this list of references into a dictionary in
+self._bibliography with the key being the key of the BibTex entry -- usually the name on the
+first line of the entry after the 'article' or 'misc' (for software) keyword.
+
+See the documentation for the Reference Handler for the other arguments to cite().
+
+# End of initial comments #
+
+# This is the citation for this plug-in, generated and used automatically.
+# You might need to edit the author, address, etc. The month, year and version fields
+# are automatically filled in with information about current version of the plug-in.
+# This is handled in seamm/nody.py, the run() method.
+
+@Misc{ionic_conductivity_step,
+	author = {Paul Saxe},
+	title = {Ionic Conductivity plug-in for SEAMM},
+	month = {$month},
+	year = {$year},
+	organization = {molssi-seamm},
+	url = {https://github.com/molssi-seamm/ionic_conductivity_step },
+	address = {USA},
+	version = {$version}
+}
+
+@book{Hansen2013,
+  author = {Hansen, Jean-Pierre and McDonald, Ian R.},
+  title = {Theory of Simple Liquids: with Applications to Soft Matter},
+  edition = {4th},
+  publisher = {Academic Press},
+  address = {Oxford},
+  year = {2013},
+  isbn = {978-0-12-387032-2}
+}