ReaxFF-lg Discrepancies in the low-gradient correction term
|
|
6
|
83
|
May 15, 2024
|
Only inserted 595 particles out of 2000
|
|
2
|
58
|
May 13, 2024
|
Bond atom missing in box size check
|
|
6
|
138
|
May 5, 2024
|
How to achieve the compute group/group when using ReaxFF?
|
|
1
|
84
|
April 11, 2024
|
Lammp create map with atom_modify
|
|
6
|
200
|
January 18, 2024
|
ReaxFF hybrid pair_style issue
|
|
7
|
271
|
January 4, 2024
|
ERROR on proc 0: Missing line in ReaxFF parameter file!
|
|
2
|
251
|
December 20, 2023
|
Postprocessing reaxff/bonds output files
|
|
1
|
136
|
December 12, 2023
|
Unreported error for velocity command in LAMMPS documentation, Questions about seed value
|
|
2
|
221
|
December 9, 2023
|
REAX Parameters for SiCOH
|
|
1
|
186
|
October 23, 2023
|
Some interesting issues encountered when simulating the adsorption of atoms on iron-carbon surfaces using the ReaxFF force field in LAMMPS with the GCMC method
|
|
2
|
359
|
October 7, 2023
|
Is it possible to use two ReaxFF hybrid force fields?
|
|
1
|
246
|
September 26, 2023
|
Coarse grained simulation of Ionic liquids
|
|
1
|
176
|
September 25, 2023
|
How can I improve my input file?
|
|
2
|
261
|
September 19, 2023
|
Fixing charge of a particle type in ReaxFF
|
|
5
|
266
|
September 18, 2023
|
Dump file fails to show element information correctly
|
|
2
|
179
|
September 16, 2023
|
ReaxFF for ionic liquids
|
|
3
|
455
|
September 2, 2023
|
Randomly select a certain number of atoms (more than 1)
|
|
10
|
368
|
August 31, 2023
|
ERROR on proc 0: Non-numeric atom coords - simulation unstable (../domain.cpp:551)
|
|
9
|
386
|
August 29, 2023
|
Does LAMMPS support eReaxFF?
|
|
1
|
376
|
August 24, 2023
|
Is it possible to ignore one atom type in ReaxFF?
|
|
6
|
277
|
August 15, 2023
|
Pressure stabilization while using Reaxff
|
|
3
|
221
|
July 6, 2023
|
How to set thermostat properly in CVD simulation?
|
|
2
|
261
|
July 5, 2023
|
How to apply a variable electric field in a simulation using ReaxFF
|
|
4
|
580
|
July 5, 2023
|
Speeding up ci-reaxFF using MPI
|
|
12
|
465
|
June 29, 2023
|
Force Field choice for polymeric electrolyte
|
|
1
|
293
|
June 27, 2023
|
Anomalous behaviour of PF6- with ECHEMDID
|
|
6
|
815
|
June 18, 2023
|
Using fix reaxff/species returns fewer molecules than actually present in the system
|
|
7
|
340
|
June 8, 2023
|
Lammps dipole/chunk with reaxff
|
|
2
|
216
|
June 1, 2023
|
Need to run an npt after another npt
|
|
1
|
213
|
May 31, 2023
|