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library: add comm->procgrid to extract_global

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This commit is contained in:
Richard Berger
2024-06-13 11:59:39 -06:00
parent 7ef9a93a75
commit 514039ed62
3 changed files with 11 additions and 3 deletions
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9
src/library.cpp
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@ -1386,6 +1386,7 @@ int lammps_extract_global_datatype(void * /*handle*/, const char *name)
if (strcmp(name,"xy") == 0) return LAMMPS_DOUBLE;
if (strcmp(name,"xz") == 0) return LAMMPS_DOUBLE;
if (strcmp(name,"yz") == 0) return LAMMPS_DOUBLE;
if (strcmp(name,"proc_grid") == 0) return LAMMPS_INT;
if (strcmp(name,"natoms") == 0) return LAMMPS_BIGINT;
if (strcmp(name,"nbonds") == 0) return LAMMPS_BIGINT;
@ -1604,6 +1605,10 @@ report the "native" data type. The following tables are provided:
- double
- 1
- triclinic tilt factor. See :doc:`Howto_triclinic`.
* - proc_grid
- int
- 3
- processor count assigned to each dimension of 3d grid. See :doc:`processors`.
.. _extract_system_settings:
@ -1861,6 +1866,10 @@ void *lammps_extract_global(void *handle, const char *name)
if (strcmp(name,"xy") == 0) return (void *) &lmp->domain->xy;
if (strcmp(name,"xz") == 0) return (void *) &lmp->domain->xz;
if (strcmp(name,"yz") == 0) return (void *) &lmp->domain->yz;
if ((lmp->comm->layout == Comm::LAYOUT_UNIFORM ||
lmp->comm->layout == Comm::LAYOUT_NONUNIFORM) &&
(strcmp(name,"proc_grid") == 0))
return (void *) &lmp->comm->procgrid;
if (strcmp(name,"natoms") == 0) return (void *) &lmp->atom->natoms;
if (strcmp(name,"ntypes") == 0) return (void *) &lmp->atom->ntypes;