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About the Atomate category
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1
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264
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November 11, 2019
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How to write a parameters to YAML file denpends on workflow
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0
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19
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July 7, 2021
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Pymatgen complaining about missing deprecated POTCAR files
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4
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88
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July 3, 2021
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What is the difference between the "default" and "strict" sets of Custodian error handlers?
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1
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34
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June 25, 2021
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Atomate.vasp.workflows not working
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5
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38
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June 22, 2021
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Error running VASP in offline mode
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4
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273
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May 28, 2021
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Insertion Worflow optimizefw_kwargs Issue
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11
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97
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May 28, 2021
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Ferroelectric job error
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4
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426
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May 18, 2021
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Error of ferroelectric workflow generation
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4
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216
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May 18, 2021
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Bug: Import statements from Pymatgen are outdated w/ newest version
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6
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158
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April 30, 2021
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Documentation Problems
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1
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71
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April 30, 2021
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Properly setting ncores for batch VASP runs
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4
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79
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March 25, 2021
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General Mongodb management question
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2
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95
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March 20, 2021
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Automating convergence testing
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3
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237
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March 20, 2021
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Plotting Raman Tensor workflow results
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0
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51
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March 15, 2021
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Missing Documentation on
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0
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66
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March 11, 2021
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Check the forces after DFPTFW
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0
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59
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February 16, 2021
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Customize KPOINTs without using user_kpoints_settings (dict)
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3
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98
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February 3, 2021
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Error running wf_raman_spectra due to modifying incar
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10
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152
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January 15, 2021
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Authentication failed for calculation on clusters
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15
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1501
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January 6, 2021
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Best practices for completing a workflow
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1
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144
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December 17, 2020
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My Simple custom validator similar to VaspFilesValidator is not working!
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0
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93
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December 7, 2020
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How to modify parameters before rerun fws?
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0
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145
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November 25, 2020
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Band structure workflow
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2
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140
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November 13, 2020
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MagneticOrderingsWF gives RuntimeError with `scan=True`
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11
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433
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November 11, 2020
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Creating new workflow with vdw
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5
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218
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October 23, 2020
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My Validator that checks existence of a file was unable to get recognized by atomate!
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0
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126
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October 22, 2020
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Large chunk files in MongoDB database
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2
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108
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October 16, 2020
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Slab relaxation and MongoDB output missing
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5
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473
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October 6, 2020
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Errors in get_wf_bulk_modulus
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2
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200
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October 5, 2020
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