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(Bug in the DB?) Band gap for mp-1211100 became 0...
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0
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5
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January 20, 2025
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A missing pre-computed R2SCAN phase diagram
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6
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20
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January 19, 2025
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Inconsistency of fix spring and fix smd cfor
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2
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16
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January 17, 2025
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Suggested substrates were missing in mp-2189
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2
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24
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January 8, 2025
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"compute spin" does not give the total magnetization
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5
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211
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January 8, 2025
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Error in POP frequency calculation
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1
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55
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December 31, 2024
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How to stop or remove a stuck NOMAD upload?
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5
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10
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December 11, 2024
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Running LAMMPSERROR: Invalid fix ave/time argument
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2
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37
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November 27, 2024
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The 'fix heat' command does not effectively simulate the constant heat flux heating process
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2
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35
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November 26, 2024
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Creating Custom pair_style, bond_style, fix_style etc
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3
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21
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November 26, 2024
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Fix print not working for minimisation
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6
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37
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November 24, 2024
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Read atomic positions from QE MD output
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0
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18
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November 15, 2024
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Can not download coordination files from the molecular database
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1
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34
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October 16, 2024
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Discrepancy in CFF parameters between EMC versions
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3
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44
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October 6, 2024
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MP API Seems to Return Materials which are not in the Database
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3
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20
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October 2, 2024
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Crystal structure of cubic Ba (mp-122) is not correct
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2
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23
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October 1, 2024
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Bug in fix adapt?
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3
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31
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September 24, 2024
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Loop cannot be run normally in python lammps module
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4
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25
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September 23, 2024
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Pair potential not calculated when bond information is added
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2
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24
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September 16, 2024
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Issues with spacegroup 71 calculations with mp-ids `mp-109XXXX`
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11
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218
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September 10, 2024
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Possible bug calculating the stress tensor
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10
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135
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September 5, 2024
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Download VASP INCAR file button doesn't work on MP website
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3
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22
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August 24, 2024
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Neigh_modify exclude dynamically
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3
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41
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August 22, 2024
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EMC bug for overriding force field charges in groups with polymerization endpoints
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1
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38
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August 17, 2024
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Colvars restart moves to wrong centers location
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4
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49
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August 9, 2024
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Floating point precision issue
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2
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29
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August 8, 2024
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Is mp-21276 orthorhombic or cubic？
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2
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22
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August 6, 2024
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Typo/error in LAMMPS documentation on pair_style born/gauss
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2
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50
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July 29, 2024
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Visualizing dislocation from different angle gives different dislocation structure
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1
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66
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July 18, 2024
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As using the "write_data" command, the number of atoms in the Group changes?
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2
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58
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July 14, 2024
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