Differences

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--- cluster:161 [2018/09/20 14:00] – hmeij07
+++ cluster:161 [2020/07/16 17:16] (current) – hmeij07
@@ Line 4: / Line 4: @@
 ==== lammps-11Aug17 ====
-and now lammps-22Aug18
+lammps-11Aug17 (n78)\\
+and now lammps-22Aug18 (n33-n37)\\
+and now lammps-5Jun19 (microway)\\
 Update:
@@ Line 32: / Line 34: @@
 # edits
 CUDA_HOME = /usr/local/cuda
-# best fitting ARCH for GTX 1080 with CUDA 8
+# best fitting ARCH for GTX 1080 with CUDA 8+
 CUDA_ARCH = -arch=sm_61
+# best fitting ARCH for P100 with CUDA 8+
+CUDA_ARCH = -arch=sm_60
+# best fitting ARCH for RTX/T4 with CUDA 10+
+CUDA_ARCH = -arch=sm_75
 http://arnon.dk/matching-sm-architectures-arch-and-gencode-for-various-nvidia-cards/
-for GTX1080 on n78
+# generate DOUBLE_DOUBLE (case matters)
 CUDA_PRECISION = -D_DOUBLE_DOUBLE
 make -f Makefile.linux.double
@@ Line 49: / Line 57: @@
 JPG_LIB =       -ljpeg
+make purge
 make yes-rigid
 make yes-gpu
@@ Line 56: / Line 66: @@
 make yes-misc
 make yes-molecule
+make yes-user-omp
+make package-update
 which mpicxx
 make mpi
@@ Line 61: / Line 74: @@
 # repeat from scratch for SINGLE_SINGLE and SINGLE_DOUBLE
+# different makefiles same edits
@@ Line 114: / Line 128: @@
    cd ..
    #no cp MAKE/Makefile.serial MAKE/Makefile.serial_icc
-   # edit MAKE/MAkefile.serial
+   add compiler flag (centos7, 2020: -std=c++11)
+   # edit MAKE/Makefile.serial
    # leave gcc++  icc/icpc -DLAMMPS_JPEG for LMP_INC
    # JPG_INC =   -I/usr/include