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correct surface_site_density input attribute typo
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rmgpy/rmg/input.py

Lines changed: 5 additions & 5 deletions
Original file line numberDiff line numberDiff line change
@@ -1,4 +1,4 @@
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#!/usr/bin/env python3
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###############################################################################
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# #
@@ -1684,12 +1684,12 @@ def save_input_file(path, rmg):
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f.write(' kineticsEstimator = {0!r},\n'.format(rmg.kinetics_estimator))
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f.write(')\n\n')
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1687-
if rmg.surfaceSiteDenisty or rmg.binding_energies:
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if rmg.surface_site_density or rmg.binding_energies:
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f.write('catalystProperties(\n')
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if rmg.surfaceSiteDenisty:
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f.write(' surface_site_density = {0!r},'.format(rmg.surface_site_density))
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if rmg.surface_site_density:
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f.write(' surfaceSiteDensity = {0!r},'.format(rmg.surface_site_density))
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if rmg.binding_energies:
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f.write(' binding_energies = {0!r},'.format(rmg.binding_energies))
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f.write(' bindingEnergies = {0!r},'.format(rmg.binding_energies))
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f.write(')\n\n')
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# Species

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