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Bug in get_cutoffs function: undefined variable supercell_structure [lattice_dynamics workflow]

Status: Open.

#793 In hackingmaterials/atomate;

· SergeevGregory opened on May 8, 2025

numpy.bool_ error

Status: Open.

#792 In hackingmaterials/atomate;

· jinlhr542 opened on Sep 21, 2024

Can't run mutiple queues on one node with error : mpirun noticed .... exited on signal 15 (Terminated)

Status: Open.

#748 In hackingmaterials/atomate;

· aijcode opened on Feb 20, 2022

Possible issue passing POTCAR to child firework

bug

Status: Open.

#661 In hackingmaterials/atomate;

· rwoodsrobinson opened on May 15, 2021

Add setup hint for Atlas users: ssl: true + authsource: admin needed in my_launchpad.yaml

improvementreported issues that considered further improvement to atomatereported issues that considered further improvement to atomate

Status: Open.

#635 In hackingmaterials/atomate;

· janosh opened on Apr 14, 2021

VASP Drone and onsite_density_matrix causing large document sizes

bug

improvementreported issues that considered further improvement to atomatereported issues that considered further improvement to atomate

Status: Open.

#577 In hackingmaterials/atomate;

· mkhorton opened on Jan 27, 2021

FEFF Drone and task doc validation

improvementreported issues that considered further improvement to atomatereported issues that considered further improvement to atomate

Status: Open.

#366 In hackingmaterials/atomate;

· shyamd opened on Jan 22, 2020

Remove DriftErrorHandler to default handlers until fixed, add warning to drone

bug

improvementreported issues that considered further improvement to atomatereported issues that considered further improvement to atomate

Status: Open.

#316 In hackingmaterials/atomate;

· mkhorton opened on Oct 18, 2019

Default POTCAR settings for Lanthanides not compatible with Hybrid DFT

bug

Status: Open.

#309 In hackingmaterials/atomate;

· utf opened on Oct 3, 2019

Improve RunVaspCustodian to store standard error output

improvementreported issues that considered further improvement to atomatereported issues that considered further improvement to atomate

Status: Open.

#297 In hackingmaterials/atomate;

· mkhorton opened on Jun 18, 2019

Polarization task doesn't write ionic polarization to database

improvementreported issues that considered further improvement to atomatereported issues that considered further improvement to atomate

Status: Open.

#296 In hackingmaterials/atomate;

· sthartman opened on Jun 12, 2019

Atomate v2: issues that require issues

improvementreported issues that considered further improvement to atomatereported issues that considered further improvement to atomate

Status: Open.

#292 In hackingmaterials/atomate;

· computron opened on May 30, 2019