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Problem on using NVT and interpreting the movement
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6
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190
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March 31, 2024
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How to convert comb3 potential unit from metal to real?
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2
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86
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March 30, 2024
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Any benchmarked code for finding thermal conductivity in III-V bulk semiconductors using the Green-Kubo formula?
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1
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61
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March 30, 2024
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Problem with bond or angle atom missing
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28
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1830
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March 29, 2024
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Add dislocation and use in lammps
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10
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236
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March 29, 2024
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Some confusion about vashishta potential of alumina
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2
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59
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March 28, 2024
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Writing a compute for bond states
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7
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113
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March 28, 2024
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How can I create an output file that includes both the calculated variables and the corresponding loop steps?
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4
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92
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March 27, 2024
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Temperature keeps increasing during nvt/nve relaxation period
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3
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82
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March 26, 2024
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Assistance Needed with LAMMPS Log File Output Interpretation
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6
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77
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March 26, 2024
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An error was reported when running the MSMPI version of lammps and questions about the openmp package
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4
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86
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March 26, 2024
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How to build a perfect MOF structure file from unit cell cif file? (cross-boundary atoms)
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7
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151
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March 25, 2024
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If I use metal unit style in lammps inputscript to calculate thermal conductivity. in what unit thermal conductivity will be printed out? and I uploaded the script below
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1
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55
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March 25, 2024
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Incorrect args for pair coefficients (src/MANYBODY/pair_eam_fs.cpp:52)
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1
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56
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March 25, 2024
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Errors about kspace_style and bond atom missing
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6
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135
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March 25, 2024
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Question about bond_coeff args
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1
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86
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March 23, 2024
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Pair_coeff boron.tersoff
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1
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74
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March 23, 2024
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The LAMMPS-SPH User's Guide has to be updated
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2
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110
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March 23, 2024
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Bond in SPH simulation
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5
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128
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March 23, 2024
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Error: Molecule topology/atom exceeds system topology/atom
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1
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162
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March 22, 2024
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Input Script to Analyze Stress vs Strain for Metal Halide Perovskites
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1
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71
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March 21, 2024
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Compute dielectric constant of free moving charged particles
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10
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150
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March 21, 2024
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Run benchmark with OpenMP only
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2
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69
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March 20, 2024
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Extract the temperature of a particle in a group
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1
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64
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March 20, 2024
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[lammps]Lost atoms in NVT after NPT simulation
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4
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108
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March 19, 2024
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CMAP atoms missing on proc error
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3
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69
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March 18, 2024
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Getting error while using meam potential with hybrid
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1
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59
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March 18, 2024
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See occurence of reactions - changing type of monomers
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6
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174
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March 15, 2024
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ERROR on proc 0: cannot open eam/alloy potential file Al99.eam.alloy: No such file or directory (src/potential_file_reader.cpp:59) Last command: pair_coeff * * Al99.eam.alloy Al
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1
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94
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March 15, 2024
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Density for solids in LAMMPS
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1
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72
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March 15, 2024
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