diff --git a/doc/src/Errors_messages.txt b/doc/src/Errors_messages.txt index fb5003e602..7f6e80948c 100644 --- a/doc/src/Errors_messages.txt +++ b/doc/src/Errors_messages.txt @@ -5729,6 +5729,16 @@ definitions. :dd The data file header lists improper but no improper types. :dd +{Incompatible KIM Simulator Model} :dt + +The requested KIM Simulator Model was defined for a different MD code +and thus is not compatible with LAMMPS. :dd + +{Incompatible units for KIM Simulator Model} :dt + +The selected unit style is not compatible with the requested KIM +Simulator Model. :dd + {Incomplete use of variables in create_atoms command} :dt The var and set options must be used together. :dd @@ -6988,6 +6998,12 @@ The atom style defined does not have this attribute. :dd The atom style defined does not have these attributes. :dd +{KIM Simulator Model has no Model definition} :dt + +There is no model definition (key: model-defn) in the KIM Simulator +Model. Please contact the OpenKIM database maintainers to verify +and potentially correct this. :dd + {KOKKOS package does not yet support comm_style tiled} :dt Self-explanatory. :dd @@ -7475,6 +7491,18 @@ Self-explanatory. :dd Self-explanatory. :dd +{Must use 'kim_style init' command before simulation box is defined} :dt + +Self-explanatory. :dd + +{Must use 'kim_style define' command after simulation box is defined} :dt + +Self-explanatory. :dd + +{Must use 'kim_style init' command before 'kim_style define'} :dt + +Self-explanatory. :dd + {Must use 'kspace_modify pressure/scalar no' for rRESPA with kspace_style MSM} :dt The kspace scalar pressure option cannot (yet) be used with rRESPA. :dd @@ -9418,6 +9446,11 @@ See the "read_data extra/special/per/atom" command for info on how to leave space in the special bonds list to allow for additional bonds to be formed. :dd +{Species XXX is not supported by this KIM Simulator Model} :dt + +The kim_style define command was referencing a species that is not +present in the requested KIM Simulator Model. :dd + {Specified processors != physical processors} :dt The 3d grid of processors defined by the processors command does not diff --git a/src/KIM/kim_style.h b/src/KIM/kim_style.h index eddc22eebc..f8c0602beb 100644 --- a/src/KIM/kim_style.h +++ b/src/KIM/kim_style.h @@ -85,34 +85,34 @@ class KimStyle : protected Pointers { E: Illegal kim_style command -Incorrect number or kind of arguments to kim_style +Incorrect number or kind of arguments to kim_style. E: Must use 'kim_style init' command before simulation box is defined -Self-explanatory +Self-explanatory. E: Must use 'kim_style define' command after simulation box is defined -Self-explanatory +Self-explanatory. E: Must use 'kim_style init' command before 'kim_style define' -Self-explanatory +Self-explanatory. E: Incompatible KIM Simulator Model The requested KIM Simulator Model was defined for a different MD code -and thus is not compatible with LAMMPS +and thus is not compatible with LAMMPS. E: Species XXX is not supported by this KIM Simulator Model The kim_style define command was referencing a species that is not -present in the requested KIM Simulator Model +present in the requested KIM Simulator Model. E: Incompatible units for KIM Simulator Model The selected unit style is not compatible with the requested KIM -Simulator Model +Simulator Model. E: KIM Simulator Model has no Model definition