|
A disconnect between "compute pressure" and "press/berendsen" when bpm package is used in 2023 feature lammps
|
|
5
|
22
|
June 7, 2023
|
|
Blocked from MP because of intensive querying?
|
|
2
|
23
|
June 7, 2023
|
|
Problems running more than 2000 million of processes
|
|
1
|
24
|
June 7, 2023
|
|
About mixing of coefficients of pair_style granular
|
|
14
|
116
|
June 7, 2023
|
|
Only one atom is being created while running 3D-crack simulation using peri package
|
|
5
|
24
|
June 6, 2023
|
|
Undefined reference to `ompi_mpi` when building lammps with cmake
|
|
4
|
50
|
June 1, 2023
|
|
Need to run an npt after another npt
|
|
1
|
33
|
May 31, 2023
|
|
Error: Illegal varable loop command: too much arguments ***RESOLVED***
|
|
2
|
38
|
May 31, 2023
|
|
Error with Reaxff (Segmentation fault: address not mapped to object at address 0x17399240)
|
|
4
|
57
|
May 31, 2023
|
|
How to obtain batch data except rare earth elements
|
|
4
|
42
|
May 30, 2023
|
|
Illegal group command
|
|
3
|
43
|
May 30, 2023
|
|
Get stuck with reaxff
|
|
2
|
52
|
May 28, 2023
|
|
Problem in simulation drawing process
|
|
7
|
227
|
May 28, 2023
|
|
Getting help to solve the error for "Bond atoms 5282 5291 missing on proc 0 at step 2515 (src/ntopo_bond_all.cpp:61)"
|
|
1
|
27
|
May 26, 2023
|
|
'Order not in orders' error
|
|
1
|
22
|
May 26, 2023
|
|
AttributeError: 'MPDataDoc' object has no attribute 'pretty_formula'
|
|
3
|
34
|
May 25, 2023
|
|
LAMMPS gives Error: Lost atoms when assign mass
|
|
10
|
44
|
May 25, 2023
|
|
Issue with wavefunction file in amset script
|
|
0
|
27
|
May 19, 2023
|
|
Error when use the command 'amset run'
|
|
0
|
20
|
May 19, 2023
|
|
Cannot find lcufft when compiling lammps with kokkos and gpu
|
|
2
|
47
|
May 18, 2023
|
|
When I use REAXFF and oscillate electric field, ERROR happen
|
|
15
|
114
|
May 16, 2023
|
|
MP rester error
|
|
1
|
48
|
May 15, 2023
|
|
A probable mistake of WenAlloy featurizer
|
|
0
|
26
|
May 8, 2023
|
|
Error in dftpy
|
|
1
|
115
|
May 8, 2023
|
|
How to build python3.10 in lammps
|
|
1
|
105
|
May 5, 2023
|
|
Publishing Results in Error "Cannot pack an upload that is packed, or packing"
|
|
2
|
41
|
May 5, 2023
|
|
New pair style
|
|
3
|
87
|
May 3, 2023
|
|
Lammps error
|
|
4
|
311
|
April 30, 2023
|
|
Error in running table.file of LAMMPS
|
|
6
|
154
|
April 28, 2023
|
|
Cuda illegal memory access(kokkos) when using multiple GPUs
|
|
11
|
117
|
April 27, 2023
|