From 33662f063111362726370a9b953d20c4eb9f3d8d Mon Sep 17 00:00:00 2001 From: Jinzhe Zeng Date: Sun, 4 Dec 2022 04:02:59 -0500 Subject: [PATCH] docs: add a note about lammps runpath Fix #2048. Signed-off-by: Jinzhe Zeng --- doc/install/install-lammps.md | 8 ++++++++ 1 file changed, 8 insertions(+) diff --git a/doc/install/install-lammps.md b/doc/install/install-lammps.md index ec79de8f4f..0be0b1ddb1 100644 --- a/doc/install/install-lammps.md +++ b/doc/install/install-lammps.md @@ -67,3 +67,11 @@ If everything works fine, you will end up with an executable `${deepmd_root}/bin ```bash ${deepmd_root}/bin/lmp -h ``` + +:::{note} +If `${tensorflow_root}` or `${deepmd_root}` is different from the prefix of LAMMPS, you need to append the library path to [`RUNPATH`](https://man7.org/linux/man-pages/man8/ld.so.8.html) of `liblammps.so`. For example, + +```sh +patchelf --set-rpath "${tensorflow_root}/lib" liblammps.so +``` +:::