[ { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/binding-energy-crystal" "instance-id" 1 "prototype-label" { "source-value" "AB_hP48_156_8a8b8c_8a8b8c" } "stoichiometric-species" { "source-value" [ "S" "Zn" ] } "a" { "source-value" 3.798 "source-unit" "angstrom" } "binding-potential-energy-per-atom" { "source-value" -3.25426 "source-unit" "eV" } "binding-potential-energy-per-formula" { "source-value" -6.50852 "source-unit" "eV" } "parameter-names" { "source-value" [ "c/a" "z1" "z2" "z3" "z4" "z5" "z6" "z7" "z8" "z9" "z10" "z11" "z12" "z13" "z14" "z15" "z16" "z17" "z18" "z19" "z20" "z21" "z22" "z23" "z24" "z25" "z26" "z27" "z28" "z29" "z30" "z31" "z32" "z33" "z34" "z35" "z36" "z37" "z38" "z39" "z40" "z41" "z42" "z43" "z44" "z45" "z46" "z47" "z48" ] } "parameter-values" { "source-value" [ 19.611954 0.031245962 0.82294101 0.69794124 0.94789385 0.57294066 0.44794138 0.32291673 0.15624799 0.54167532 0.41667556 0.2916749 0.6666742 0.12500022 2.189229e-06 0.79167419 0.91666914 0.90624878 0.072915094 0.73957835 0.65622656 0.19789327 0.28124688 0.48957808 0.40622712 0.37499469 0.87499783 0.70833525 0.62499335 0.45833576 0.25000203 0.16666592 0.04166975 0.5312264 0.11457855 0.8645781 0.61457788 0.9896027 0.23960286 0.36457992 0.78122681 0.58333651 0.2083371 0.4999939 0.083335277 0.74999275 0.83333726 0.33333383 0.95833689 ] } } { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/crystal-structure-npt" "instance-id" 2 "prototype-label" { "source-value" "AB_hP48_156_8a8b8c_8a8b8c" } "stoichiometric-species" { "source-value" [ "S" "Zn" ] } "a" { "source-value" 3.798 "source-unit" "angstrom" } "cell-cauchy-stress" { "source-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] "source-unit" "eV/angstrom^3" } "temperature" { "source-value" 0.0 "source-unit" "K" } "parameter-names" { "source-value" [ "c/a" "z1" "z2" "z3" "z4" "z5" "z6" "z7" "z8" "z9" "z10" "z11" "z12" "z13" "z14" "z15" "z16" "z17" "z18" "z19" "z20" "z21" "z22" "z23" "z24" "z25" "z26" "z27" "z28" "z29" "z30" "z31" "z32" "z33" "z34" "z35" "z36" "z37" "z38" "z39" "z40" "z41" "z42" "z43" "z44" "z45" "z46" "z47" "z48" ] } "parameter-values" { "source-value" [ 19.611954 0.031245962 0.82294101 0.69794124 0.94789385 0.57294066 0.44794138 0.32291673 0.15624799 0.54167532 0.41667556 0.2916749 0.6666742 0.12500022 2.189229e-06 0.79167419 0.91666914 0.90624878 0.072915094 0.73957835 0.65622656 0.19789327 0.28124688 0.48957808 0.40622712 0.37499469 0.87499783 0.70833525 0.62499335 0.45833576 0.25000203 0.16666592 0.04166975 0.5312264 0.11457855 0.8645781 0.61457788 0.9896027 0.23960286 0.36457992 0.78122681 0.58333651 0.2083371 0.4999939 0.083335277 0.74999275 0.83333726 0.33333383 0.95833689 ] } } ]