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Add TIP4P water molecules by “read_data” and “create_atoms"
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3
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20
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August 9, 2025
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Disappearance of Energy Corrections for mp‑1100405 (ScTeRh) under GGA/GGA+U
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3
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18
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August 8, 2025
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ERROR on proc 3: Bond atoms 1888 1943 missing on proc 3 at step 3486 (src/ntopo_bond_all.cpp:61)
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5
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33
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August 4, 2025
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Restarting calculation with MACE forcefields
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6
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46
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August 4, 2025
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Splining pair_style MEAM with ZBL Potential using hybrid/overlay
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6
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884
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July 29, 2025
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Mp-api robocrys keyword search misses materials
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3
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43
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July 25, 2025
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High Wall Time
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1
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17
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July 17, 2025
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An error was reported in the gas hydrate simulation
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6
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43
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July 16, 2025
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Unexpected Shear Stress Drop After Restarting a Granular Simulation
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1
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29
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July 15, 2025
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RuntimeError: Calculations were not performed using the same k-point mesh (3, 3, 3) != (3, 3, 1)
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2
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358
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July 9, 2025
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LAMMPS combined GPU: ERROR on proc 1: Neighbor list problem on the GPU
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5
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30
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July 8, 2025
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LAMMPS Reading Unrealistically Large Atom Count from Atomsk-Generated File
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3
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38
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July 7, 2025
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Lammps doesn't print detail detail error without mpirun
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1
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23
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June 23, 2025
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Structure crashing in LAMMPS with SNAP potentials
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2
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38
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June 20, 2025
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Incident Particle gaining energy
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11
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26
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June 19, 2025
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Validation error importing MPRester, maybe to do with EmmetSettings
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5
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30
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June 20, 2025
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Issue with time after restart
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2
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17
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June 18, 2025
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Cuda driver error 700 in call at file 'geryon/nvd_memory.h' in line 502: Error when using pair_style hybrid/overlay and GPU
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1
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44
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June 18, 2025
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Inpot file for NH3 molecular crystal in exciting
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2
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25
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June 17, 2025
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Help with ERROR: Lost atoms in LAMMPS?
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4
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1205
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June 15, 2025
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Discrepancy Between API and Website for Stable Structures (e.g., Ag Metal)
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5
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19
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June 11, 2025
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Atom lost across periodic boundary despite low speed
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0
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21
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June 6, 2025
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Problem in deleting overlapping polymer atoms and their entire chains using delete_atoms overlap in LAMMPS
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3
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34
|
May 24, 2025
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Problem while reaxff simulation of ZnO deposited on silica glass SiO2 substrate
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8
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96
|
May 24, 2025
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There was an issue displaying the page. Possible reasons include: you haven't accepted the GNoME terms of use; or the material with mpid: mp-767093 does not exist in our database
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1
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19
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May 23, 2025
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Access magnetic ordering using mp_api
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8
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209
|
May 22, 2025
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Getting segmentation faults from ReaxFF
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5
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47
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May 20, 2025
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Error in MOF + CO2 system with gcmc and fix rigid/nvt/small
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5
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435
|
May 17, 2025
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WARNING : Breaking symmetry due to perfect biradical
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4
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27
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May 14, 2025
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Adding single-layer graphene using reaxff force field error：Incorrect args for pair coefficients
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2
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29
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May 13, 2025
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