{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.176849 1.681974 3.211274 ] [ 2.864727 5.809081 2.248654 ] [ 2.905691 3.612446 1.71083 ] [ 4.50356 2.090932 1.710731 ] [ 5.648677 2.904188 3.876429 ] [ 4.83518 4.522991 2.188517 ] [ 3.438619 4.083879 4.381538 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.176849e-10 1.681974e-10 3.211274e-10 ] [ 2.864727e-10 5.809081e-10 2.248654e-10 ] [ 2.905691e-10 3.612446e-10 1.71083e-10 ] [ 4.503560000000001e-10 2.090932e-10 1.710731e-10 ] [ 5.648677e-10 2.904188e-10 3.876429e-10 ] [ 4.835180000000001e-10 4.522991000000001e-10 2.188517e-10 ] [ 3.438619e-10 4.083879e-10 4.381538e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.6004847 -9.3874571 4.0006512 ] [ -7.0141398 14.9607883 -1.5602706 ] [ -12.6667239 -1.2605503 -11.4373596 ] [ 6.7861318 -13.43273 -9.0019832 ] [ 11.8416584 -4.8007057 8.6463222 ] [ 14.0852249 10.1703603 -5.4460724 ] [ -4.4316667 3.7502944 14.7987125 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.37794955138881e-08 -1.504036429438297e-08 6.409749820615465e-09 ] [ -1.123789080258279e-08 2.396982524299818e-08 -2.499829077441589e-09 ] [ -2.02943288947086e-08 -2.019624220002426e-09 -1.832467015480244e-08 ] [ 1.087258171562742e-08 -2.152160595951878e-08 -1.442276702387437e-08 ] [ 1.897242823997993e-08 -7.691578435881298e-09 1.385293528474402e-08 ] [ 2.256701803349002e-08 1.629471349777248e-08 -8.725569874464147e-09 ] [ -7.100312777917888e-09 6.008634008797164e-09 2.371015118544072e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 74.017025 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.185883469961691e-17 } "relaxed-configuration-positions" { "source-value" [ [ 1.122892 0.0793693 4.0227683 ] [ 1.8035786 8.3705639 2.2565805 ] [ 1.2106066 3.527017 -0.2808271 ] [ 5.5581062 0.2291016 0.4069237 ] [ 7.3649176 1.9873596 5.2950687 ] [ 6.5582986 5.7101663 1.2950588 ] [ 2.7549034 4.8019133 6.3324001 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.122892e-10 7.93693e-12 4.0227683e-10 ] [ 1.8035786e-10 8.3705639e-10 2.2565805e-10 ] [ 1.2106066e-10 3.527017e-10 -2.808271e-11 ] [ 5.5581062e-10 2.291016e-11 4.069237e-11 ] [ 7.3649176e-10 1.9873596e-10 5.2950687e-10 ] [ 6.5582986e-10 5.7101663e-10 1.2950588e-10 ] [ 2.7549034e-10 4.8019133e-10 6.3324001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ -0.0 -0.0 -0.0 ] [ 0.0 -0.0 -0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ -0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" -3.5527137e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.692074830535866e-34 } }