|
Equilibration or relaxation of HEA
|
|
2
|
10
|
November 14, 2025
|
|
Lammps variable parsing
|
|
6
|
57
|
November 11, 2025
|
|
Different temperature/pressure behavior in small vs. large F-diamane systems using ReaxFF
|
|
10
|
105
|
November 9, 2025
|
|
Applying Constant Shear Stress to Dislocation Using Lammps
|
|
10
|
1309
|
November 5, 2025
|
|
WARNING: force values in table are inconsistent with -dE/dr
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|
3
|
37
|
November 4, 2025
|
|
Confusing behaviour with Compute FEP command
|
|
0
|
25
|
November 4, 2025
|
|
Achieving same density with different quench rates for amorphous silica (Vashishta potential)
|
|
2
|
39
|
November 3, 2025
|
|
Exit the simulation box
|
|
6
|
66
|
October 29, 2025
|
|
Warning of system not charge neutral with TIP4P potential
|
|
4
|
278
|
October 28, 2025
|
|
Confusion about the special bonds of LAMMPS
|
|
1
|
73
|
October 24, 2025
|
|
Which KSpace style is compatible with pair_style lj/charmm/coul/charmm?
|
|
12
|
79
|
October 24, 2025
|
|
Calculation of pulling energy (spring) in lammps
|
|
23
|
1085
|
October 22, 2025
|
|
Molecular center-of-mass drift in TIP5P supercooled water simulations
|
|
2
|
44
|
October 16, 2025
|
|
Lammps gpu acceleration
|
|
2
|
52
|
October 13, 2025
|
|
Calculating the dielectic permittivity spectrum
|
|
4
|
34
|
October 12, 2025
|
|
Improper style for OPLS-AA force field
|
|
10
|
802
|
October 9, 2025
|
|
Berendsen thermostat
|
|
2
|
41
|
October 7, 2025
|
|
Seeking Help on Using Silvera-Goldman Potential in LAMMPS for Liquid Hydrogen Simulation
|
|
9
|
40
|
October 5, 2025
|
|
Question about read_data add append
|
|
3
|
22
|
September 18, 2025
|
|
Error in LAMMPS
|
|
2
|
65
|
September 17, 2025
|
|
Auxiliary heating
|
|
2
|
53
|
September 16, 2025
|
|
Ambertools conversion script progress
|
|
3
|
276
|
September 12, 2025
|
|
Movement of the cylindrical area
|
|
2
|
32
|
September 3, 2025
|
|
ReaxFF bond order cutoffs vs VMD heuristic bond assignment approach
|
|
2
|
43
|
August 29, 2025
|
|
Help with AlSi10Mg alloy hybrid potential (LJ parameters issue)
|
|
4
|
49
|
August 20, 2025
|
|
Pressure Minimisation Failing While Trying to optimise Lattice Parameters at 0 K
|
|
5
|
42
|
August 20, 2025
|
|
NPT simulation stabilization
|
|
4
|
96
|
August 18, 2025
|
|
Error debugging
|
|
2
|
46
|
August 15, 2025
|
|
How to discuss LAMMPS improvements with developers
|
|
1
|
49
|
August 15, 2025
|
|
Unexpected increasing trend of Frenkel pair numbers in cascade simulations
|
|
1
|
60
|
August 13, 2025
|