|
Non-zero energy above cutoff for coul/dsf potential
|
|
2
|
270
|
October 21, 2022
|
|
Kspace ewald (coul/long potential) generates strange forces
|
|
4
|
412
|
October 21, 2022
|
|
Fix pour gives an error 'atom attributes radius, rmass'
|
|
1
|
422
|
October 21, 2022
|
|
How to minimize with fix addforce?
|
|
4
|
354
|
October 20, 2022
|
|
Fracture of a Crosslinked Polymer
|
|
4
|
313
|
October 20, 2022
|
|
The vacuum space required for the ribbon under buckling?
|
|
1
|
162
|
October 19, 2022
|
|
Shake error in the presence of an electric field
|
|
7
|
378
|
October 19, 2022
|
|
About neigh_modify command and dangerous builds
|
|
3
|
1581
|
October 19, 2022
|
|
Variance of density/number using chunks
|
|
3
|
294
|
October 18, 2022
|
|
Difficulty in modeling water molecules(TIP3P) with polymer(COMPASS)
|
|
7
|
761
|
October 17, 2022
|
|
OMP accelaration reaxff
|
|
1
|
267
|
October 17, 2022
|
|
LAMMPS loop fails in GPU accelerate
|
|
7
|
428
|
October 14, 2022
|
|
Using NPT ensembles in deposit simulations
|
|
3
|
394
|
October 13, 2022
|
|
Generating LAMMPS Data File and Forcefield
|
|
5
|
2817
|
October 11, 2022
|
|
About method of getting P-h curve
|
|
4
|
338
|
October 10, 2022
|
|
How to select the first layer of water close to a nanotube
|
|
1
|
242
|
October 9, 2022
|
|
The influence of the "read_data" command on the "rerun" calculation
|
|
1
|
257
|
October 8, 2022
|
|
Print computed energy
|
|
3
|
973
|
October 7, 2022
|
|
Interatomic potential
|
|
1
|
286
|
October 7, 2022
|
|
Output the first to the third shell around an atom
|
|
2
|
190
|
October 7, 2022
|
|
How to calculate sum of (Xi-Xcm)^2 for each molecule?
|
|
2
|
223
|
October 6, 2022
|
|
Cannot perform "minimize" or "fix nve/limit" with parallelization
|
|
5
|
547
|
October 6, 2022
|
|
Deposition Behavior?
|
|
4
|
438
|
October 5, 2022
|
|
Error in simulating system using region and fix wall/region command
|
|
4
|
1073
|
October 4, 2022
|
|
Workflow Tools for LAMMPS
|
|
3
|
574
|
October 3, 2022
|
|
Cuda illegal memory access(kokkos) multiple MPI per GPU
|
|
18
|
893
|
October 2, 2022
|
|
Write converged values of PE and force norm after minimization to a file
|
|
1
|
212
|
October 2, 2022
|
|
Twisting of infinite CNT using periodic boundary conditions
|
|
5
|
235
|
October 2, 2022
|
|
Doubt to save the center of mass of previous timestep
|
|
1
|
295
|
September 30, 2022
|
|
About NEB calculation with intermediate replica
|
|
4
|
510
|
September 30, 2022
|