ICODE-ADC/lammps
4
0
Fork 0
Code Issues Pull Requests Actions Packages Projects Releases Wiki Activity

Fixed a bug with extra being nullptr when _host_view is true: always allocate extra

Browse Source 
(Note that BaseAmoeba has its own cast_extra_data() that doesn't know if extra is allocated properly, it is the case when _host_view is false for dedicated GPUs for example)
This commit is contained in:
Trung Nguyen
2023-01-18 20:04:45 -06:00
parent f86375c992
commit eddd3d6f25
3 changed files with 9 additions and 14 deletions
Download Patch File Download Diff File Expand all files Collapse all files

2
lib/gpu/lal_device.cpp
View File

@ -490,7 +490,7 @@ int DeviceT::init(Answer<numtyp,acctyp> &ans, const bool charge,
_data_in_estimate++;
if (!atom.velocity() && vel)
_data_in_estimate++;
if (atom.using_extra()==false && extra_fields>0)
if (atom.using_extra() && extra_fields>0)
_data_in_estimate++;
if (!atom.add_fields(charge,rot,gpu_nbor,gpu_nbor>0 && maxspecial,vel,extra_fields))
return -3;