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clean up check_incar
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-6
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2 files changed

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examples/using_validation_docs.ipynb

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@@ -2,7 +2,7 @@
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"cells": [
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{
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"cell_type": "code",
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"execution_count": 2,
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"execution_count": null,
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"id": "b116c8b3-e927-401b-aed8-994fe5279b54",
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"metadata": {},
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"outputs": [],
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},
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{
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"cell_type": "code",
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"execution_count": 3,
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"execution_count": null,
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"id": "80064515-1e98-43da-b075-5a4c41ede437",
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"metadata": {},
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"outputs": [],
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},
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{
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"cell_type": "code",
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"execution_count": 4,
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"execution_count": 3,
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"id": "0f660f54-ca8a-466c-b382-2f0fac46d8bf",
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"metadata": {},
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"outputs": [
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},
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{
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"cell_type": "code",
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"execution_count": 5,
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"execution_count": null,
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"id": "25b85de2",
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"metadata": {},
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"outputs": [

pymatgen/io/validation/check_incar.py

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@@ -118,8 +118,6 @@ def check(
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append_comments=working_params.defaults[key]["comment"],
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severity=working_params.defaults[key]["severity"],
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)
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# if key == "ISIF":
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# print("batz",key,working_params.parameters[key], parameters.get("ISIF"),working_params.valid_values[key],working_params.defaults[key])
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class UpdateParameterValues:

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