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pyciaaw: CIAAW for python.

Project description

Introduction

Python wrapper around the Fortran ciaaw library. The Fortran library does not need to be installed, the python wrapper embeds all needed fortran dependencies for Windows and MacOS. On linux, you might have to install libgfortran if it is not distributed by default with your linux distribution.

Installation

pip install pyciaaw

Usage

print("########## CIAAW VERSION ##########")
print("version ", pyciaaw.__version__)

print("########## CIAAW SAW ##########")
elmt = pyciaaw.saw.H
print("Element: ", elmt["element"])
print("Symbol: ", elmt["symbol"])
print("Z: ", elmt["z"])
print("standard atomic weight max: ", elmt["saw_max"])
print("standard atomic weight min: ", elmt["saw_min"])
print("standard atomic weight: ", elmt["saw"])
print("standard atomic weight uncertainty: ", elmt["saw_u"])
print("abredged standard atomic weight: ", elmt["asaw"])
print("abredged standard atomic weight uncertainty: ", elmt["asaw_u"])
print()

elmt = pyciaaw.saw.F
print("Element: ", elmt["element"])
print("Symbol: ", elmt["symbol"])
print("Z: ", elmt["z"])
print("standard atomic weight max: ", elmt["saw_max"])
print("standard atomic weight min: ", elmt["saw_min"])
print("standard atomic weight: ", elmt["saw"])
print("standard atomic weight uncertainty: ", elmt["saw_u"])
print("abredged standard atomic weight: ", elmt["asaw"])
print("abredged standard atomic weight uncertainty: ", elmt["asaw_u"])

License

MIT

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