Update lib/kim/README

Fix some typos and update to non-deprecated form of kim commands
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ilia-nikiforov-umn
2023-06-16 12:21:42 -05:00
committed by GitHub
parent 9673c22cc7
commit 6f5e5746b3

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@ -1,6 +1,6 @@
This directory contains build settings for the KIM API library which is
required to use the KIM package and its kim_init, kim_interactions, kim_query,
and pair_kim commands in a LAMMPS input script.
required to use the KIM package and its kim init, kim interactions and kim query
commands in a LAMMPS input script.
Information about the KIM project can be found at https://openkim.org.
The KIM project is lead by Ellad Tadmor and Ryan Elliott (U Minn).
@ -13,7 +13,7 @@ do the same thing by typing "python Install.py" from within this
directory, or you can do it manually by following the instructions
below.
Use of the kim_query command requires that the CURL library (libcurl)
Use of the kim query command requires that the CURL library (libcurl)
development package and its configuration query tool, curl-config, are
installed. The provided Makefile.lammps is set up to automatically detect this.
@ -29,7 +29,7 @@ $ printf "${PWD}/installed-kim-api-X-X.Y.Z" > ./kim-prefix.txt
2. Download and unpack the kim-api
$ wget http://s3.openkim.org/kim-api/kim-api-X.Y.Z.txz
$ tar zxvf kim-api-X.Y.Z.txz
$ tar xvf kim-api-X.Y.Z.txz
# configure the kim-api
$ cd kim-api-X.Y.Z
@ -50,7 +50,7 @@ $ rm -rf kim-api-X.Y.Z.txz
5. To add items do the following (replace the kim item name with your
desired value)
$ source ${PWD}/kim-api-X.Y.Z/bin/kim-api-activate
$ source ${PWD}/installed-kim-api-X.Y.Z/bin/kim-api-activate
$ kim-api-collections-management install system EAM_ErcolessiAdams_1994_Al__MO_324507536345_002
@ -59,7 +59,7 @@ $ kim-api-collections-management install system EAM_ErcolessiAdams_1994_Al__MO_3
When these steps are complete you can build LAMMPS with the KIM
package installed:
$ cd lammpos/src
$ cd lammps/src
$ make yes-kim
$ make g++ (or whatever target you wish)