compute
| Topic | Replies | Views | Activity | |
|---|---|---|---|---|
| Compute temperature in lammps |
|
1 | 31 | February 21, 2025 |
| Writing/modifying compute for a custom order function |
|
2 | 50 | December 10, 2024 |
| Writing a compute for bond states |
|
7 | 298 | March 28, 2024 |
| Compute efield/wolf/atom output in force units |
|
3 | 204 | September 11, 2023 |
| Issues with compute com: "compute used in variable between runs is not current" |
|
2 | 869 | March 26, 2023 |
| Detecting error in pair style while computing fep: compute fep pair style does not exist (src/FEP/compute_fep.cpp:207) |
|
5 | 536 | February 7, 2023 |
| [lammps-users] WARNING: Compute pe/tally only called from pair style (src/TALLY/compute_pe_tally.cpp:75) |
|
5 | 606 | January 18, 2023 |
| Thermo_style custom command has different results compared to compute command |
|
5 | 657 | December 27, 2022 |
| How to dump potential energy of per atom after minimization |
|
2 | 1520 | September 9, 2022 |