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Write_data records the atoms incorrectly
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3
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35
|
March 11, 2026
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Neigh_modify exclude dynamically
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4
|
89
|
March 5, 2026
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Pressure nan and E_pair inf
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2
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35
|
February 26, 2026
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Atom selection around specific atoms
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2
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29
|
February 24, 2026
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Illegal fix bond/create command
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2
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18
|
February 23, 2026
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Which KSpace style is compatible with pair_style lj/charmm/coul/charmm?
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16
|
171
|
February 12, 2026
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All pair coeffs are not set.
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1
|
55
|
January 28, 2026
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Not a valid floating-point number REAXFF?
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3
|
549
|
January 28, 2026
|
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Problem with lattice and create_atoms
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5
|
52
|
January 26, 2026
|
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Different temperature/pressure behavior in small vs. large F-diamane systems using ReaxFF
|
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16
|
263
|
January 23, 2026
|
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Best way to model core-shell polymer nanoparticles
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14
|
138
|
January 15, 2026
|
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TIP4P simulation error
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1
|
38
|
January 14, 2026
|
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Need help to build nano scratching script
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3
|
83
|
December 28, 2025
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Segmentation fault in FFTW (fftw_plan_awake) during PPPM deallocation after run / during write_data init (macOS, MPI)
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5
|
84
|
December 26, 2025
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Ring Polymer tangential Force calculation
|
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1
|
36
|
December 17, 2025
|
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How to model O₂ with a COM dummy charge site (TIP4P-like) in LAMMPS?
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2
|
53
|
December 12, 2025
|
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Problem with replicate command
|
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2
|
70
|
December 11, 2025
|
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LAMMPS + Mace
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4
|
176
|
December 11, 2025
|
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ERROR on proc 29: Bond atoms 56578 59390 missing on proc 29 at step 35369
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7
|
87
|
December 11, 2025
|
|
How to simulate friction Coefficient and Wear of High Entropy Alloys Nitride?
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1
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45
|
December 10, 2025
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Simulate the friction interaction of ptfe
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2
|
481
|
December 10, 2025
|
|
MD Simulation of 2D polymers. Ok with a "small" molecule, crash with a larger one. Suggestions greatly appreciated
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26
|
781
|
December 10, 2025
|
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unstable and lost atoms in
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1
|
31
|
December 4, 2025
|
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Modifiying Cr element composition from a slab data
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3
|
53
|
November 24, 2025
|
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Si irradiation - Simulation runs but no Implantation and Vacancy profile on output
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1
|
51
|
November 22, 2025
|
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Insert the atom at the coordinate point
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1
|
46
|
November 20, 2025
|
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Lammps variable parsing
|
|
7
|
119
|
November 19, 2025
|
|
Definition for DAT
|
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4
|
197
|
November 18, 2025
|
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The problem with sputtering
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6
|
136
|
November 15, 2025
|
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Equilibration or relaxation of HEA
|
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3
|
63
|
November 15, 2025
|