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How to print string literal as a thermo column?
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1
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26
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March 20, 2026
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Write_data records the atoms incorrectly
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3
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40
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March 11, 2026
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Neigh_modify exclude dynamically
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4
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92
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March 5, 2026
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Pressure nan and E_pair inf
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2
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35
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February 26, 2026
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Atom selection around specific atoms
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2
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32
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February 24, 2026
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Illegal fix bond/create command
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2
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20
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February 23, 2026
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Which KSpace style is compatible with pair_style lj/charmm/coul/charmm?
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16
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173
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February 12, 2026
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All pair coeffs are not set.
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1
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57
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January 28, 2026
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Not a valid floating-point number REAXFF?
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3
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550
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January 28, 2026
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Problem with lattice and create_atoms
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5
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52
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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
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263
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January 23, 2026
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Best way to model core-shell polymer nanoparticles
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14
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142
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January 15, 2026
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TIP4P simulation error
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1
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40
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January 14, 2026
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Need help to build nano scratching script
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3
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83
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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
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84
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December 26, 2025
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Ring Polymer tangential Force calculation
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1
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37
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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
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53
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December 12, 2025
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Problem with replicate command
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2
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71
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December 11, 2025
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LAMMPS + Mace
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4
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183
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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
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88
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December 11, 2025
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How to simulate friction Coefficient and Wear of High Entropy Alloys Nitride?
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1
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45
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December 10, 2025
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Simulate the friction interaction of ptfe
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2
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481
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December 10, 2025
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MD Simulation of 2D polymers. Ok with a "small" molecule, crash with a larger one. Suggestions greatly appreciated
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26
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785
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December 10, 2025
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unstable and lost atoms in
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1
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32
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December 4, 2025
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Modifiying Cr element composition from a slab data
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3
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53
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November 24, 2025
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Si irradiation - Simulation runs but no Implantation and Vacancy profile on output
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1
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51
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November 22, 2025
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Insert the atom at the coordinate point
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1
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46
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November 20, 2025
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Lammps variable parsing
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7
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120
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November 19, 2025
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Definition for DAT
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4
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198
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November 18, 2025
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The problem with sputtering
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6
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137
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November 15, 2025
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