Axel Kohlmeyer c581fca39a Merge branch 'develop' into mliappy_unified

2022-09-24 03:07:31 -04:00

..

COLVARS.cmake

disable warnings with PGI/NVHPC compilers and import CMAKE_TUNE_FLAGS

2022-04-20 17:39:33 -04:00

COMPRESS.cmake

remove feature for automatic jpeg/png/zlib library download and build

2022-05-28 15:20:22 -04:00

CORESHELL.cmake

cmake: make more include files consistent

2020-04-05 15:03:25 -06:00

DPD-SMOOTH.cmake

recover compilation with CMake

2021-06-29 22:18:27 -04:00

GPU.cmake

PR comments

2022-07-27 06:25:36 +00:00

H5MD.cmake

HDF5 library may be parallel which is an error with serial LAMMPS

2022-04-10 12:07:54 -04:00

INTEL.cmake

improve support for intel compilers on windows

2022-05-18 09:14:18 -04:00

KIM.cmake

Update cmake/Modules/Packages/KIM.cmake

2021-04-05 15:36:14 -04:00

KOKKOS.cmake

Update Kokkos version in CMake

2022-07-01 14:13:08 -06:00

KSPACE.cmake

cmake: consistent usage of find variable

2020-09-08 09:35:45 -06:00

LATTE.cmake

add USE_INTERNAL_LINALG to workaround passing BLAS/LAPACK settings to external projects

2022-07-21 05:42:23 -04:00

MACHDYN.cmake

disable CUDA support with Eigen3

2022-04-20 18:50:55 -04:00

MDI.cmake

update MDI library to version 1.4.12 which plugs memory leaks on initialization

2022-09-18 11:04:57 -04:00

MISC.cmake

Correctly handle the dependency of pair style (and fix) srp/react on the MC package

2022-07-20 17:01:44 -04:00

ML-HDNNP.cmake

make certain to switch to the expected source folder when building n2p2 lib

2022-07-01 05:49:24 -04:00

ML-IAP.cmake

Initial commit of mliap unified work

2022-04-15 14:22:46 -06:00

ML-PACE.cmake

refactor LAMMPS plugin building to share more code and to add a demo for ML-PACE

2022-06-04 10:59:25 -04:00

ML-QUIP.cmake

try to enforce QUIP submodule update strategy

2022-06-01 22:26:35 -04:00

MOLFILE.cmake

bulk rename of remaining USER- packages

2021-06-29 20:12:59 -04:00

MSCG.cmake

add additional function argument where we can supply our own CMakeLists.txt file

2021-11-03 11:50:39 -04:00

NETCDF.cmake

bulk rename of remaining USER- packages

2021-06-29 20:12:59 -04:00

OPENMP.cmake

update defines from -DLMP_USER-<PKG> to -DLMP_<PKG> for consistency

2021-08-06 14:07:43 -04:00

OPT.cmake

cmake: make more include files consistent

2020-04-05 15:03:25 -06:00

PHONON.cmake

PHONON package is now only a soft dependency on KSPACE

2021-12-18 18:22:47 -05:00

PLUMED.cmake

add support for plumed 2.6.6, 2.7.4, and 2.8.0 (default 2.7.4)

2022-02-25 16:34:37 -05:00

PYTHON.cmake

make search for python libraries consistent with search for python interpreter

2022-07-19 13:28:43 -04:00

QEQ.cmake

correctly remove dependent sources for fix QEQ

2021-06-06 18:25:16 -04:00

QMMM.cmake

bulk rename of remaining USER- packages

2021-06-29 20:12:59 -04:00

SCAFACOS.cmake

must have patch command available to compile ScaFaCoS

2021-09-29 07:50:53 -04:00

VORONOI.cmake

Building voro++ lib as part of LAMMPS requires the "patch" program

2021-09-24 17:07:59 -04:00

VTK.cmake

bulk rename of remaining USER- packages

2021-06-29 20:12:59 -04:00