|
Unexpected defects during nanocutting and nanogrinding
|
|
0
|
3
|
January 21, 2025
|
|
Wrong bonding in output cif file
|
|
4
|
16
|
January 21, 2025
|
|
Good amorphous silica structure by BKS
|
|
1
|
8
|
January 20, 2025
|
|
Fix command based on MoleculeID and AtomID as well as GroupID
|
|
4
|
20
|
January 20, 2025
|
|
ERROR on proc 17: Bond atoms 4087 4095 missing,When I add molecules to the box
|
|
2
|
13
|
January 19, 2025
|
|
Request for assistance : Spin Alignment in Gd-Fe Multilayer System with Fe Anisotropy
|
|
7
|
67
|
January 15, 2025
|
|
How to control the temperature fluctuation during MD simulations with ReaxFF
|
|
4
|
46
|
January 13, 2025
|
|
Neighbor command for kMC
|
|
6
|
371
|
January 12, 2025
|
|
How to change a simulation box
|
|
2
|
37
|
January 12, 2025
|
|
How to get the “structure” feature?
|
|
6
|
1530
|
January 12, 2025
|
|
How to create a periodic crystal structure with lots of angle, dihedral and improper interactions efficiently
|
|
5
|
101
|
January 12, 2025
|
|
Creating bilayer of metal glass-crystal system
|
|
2
|
33
|
January 11, 2025
|
|
Why dose the metal be fixed without any setforce command?
|
|
2
|
13
|
January 9, 2025
|
|
3D Printing a Structure from MP
|
|
1
|
17
|
January 8, 2025
|
|
Patchy particle simulation to prepare coarse-grain simulations of microgels
|
|
1
|
32
|
January 6, 2025
|
|
Constrain searches to 2D materials (e.g. Xenes, MXenes, TMDs)
|
|
3
|
18
|
January 7, 2025
|
|
Calculation of the Surface Tension of Spherical Nanodroplets
|
|
7
|
96
|
January 7, 2025
|
|
Pair_style nb3b/screened
|
|
3
|
11
|
January 7, 2025
|
|
How to control the thermal gradient
|
|
0
|
17
|
January 7, 2025
|
|
Applying Constant Shear Stress to Dislocation Using Lammps
|
|
11
|
1017
|
January 6, 2025
|
|
Heterogeneous Nucleation of Ice on Carbon Surfaces
|
|
4
|
29
|
January 5, 2025
|
|
How to calculate cohesive energy density by lammps
|
|
7
|
677
|
December 30, 2024
|
|
Problems that occur when using the fix ave/time command
|
|
2
|
33
|
December 28, 2024
|
|
Molecular simulation of thermostat
|
|
2
|
55
|
December 26, 2024
|
|
Optimized COMB force field parameters for magnetite
|
|
2
|
19
|
December 24, 2024
|
|
Problems with bonds lengths when displaying periodic trajectories
|
|
1
|
16
|
December 23, 2024
|
|
How to take type of a particle in a if condition?
|
|
2
|
25
|
December 20, 2024
|
|
How to use MPI in fix external
|
|
3
|
46
|
December 20, 2024
|
|
Get Cohesive energy from Materials Project
|
|
19
|
119
|
December 19, 2024
|
|
Charge density visualization for Materials Project materials
|
|
0
|
21
|
December 19, 2024
|