{ "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" [ [ 2.930378 5.180054 2.851976 ] [ 5.738994 3.052967 1.218676 ] [ 3.217774 2.94037 2.40806 ] [ 5.439965 2.572298 3.526756 ] [ 4.050256 4.656384 1.057411 ] [ 5.133306 4.977378 3.451883 ] [ 3.497867 4.079859 4.731393 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.930378e-10 5.180054e-10 2.851976e-10 ] [ 5.738994e-10 3.052967000000001e-10 1.218676e-10 ] [ 3.217774e-10 2.94037e-10 2.40806e-10 ] [ 5.439965e-10 2.572298e-10 3.526756e-10 ] [ 4.050256e-10 4.656384e-10 1.057411e-10 ] [ 5.133306e-10 4.977378e-10 3.451883e-10 ] [ 3.497867e-10 4.079859e-10 4.731393e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 105.2979136 -112.7380673 -2.7837857 ] [ 1.1115982 -23.7079446 -37.7941446 ] [ 41.5453944 117.8482001 -14.5997887 ] [ 10.4531969 17.5968839 -28.6474623 ] [ -56.9917602 -44.7508378 95.866607 ] [ -99.7703254 -35.5177951 65.9378 ] [ -1.6460174 81.2695608 -77.9792256 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.687058567788708e-07 -1.806262971903795e-07 -4.460116402603333e-09 ] [ 1.780976662436459e-09 -3.798431487828648e-08 -6.055289538013727e-08 ] [ 6.656306015799444e-08 1.888136325591765e-07 -2.339144031647723e-08 ] [ 1.674786782378123e-08 2.819331621579079e-08 -4.589829472045589e-08 ] [ -9.131086652297117e-08 -7.169874667508397e-08 1.535952377162608e-07 ] [ -1.598496841224567e-07 -5.690578140041969e-08 1.056440024573652e-07 ] [ -2.637210617437432e-09 1.302081913692023e-07 -1.249364931937346e-07 ] ] } "unrelaxed-potential-energy" { "source-value" -33.64110727636717 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.389899602008286e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.930378 5.180054 2.851976 ] [ 5.738994 3.052967 1.218676 ] [ 3.217774 2.94037 2.40806 ] [ 5.439965 2.572298 3.526756 ] [ 4.050256 4.656384 1.057411 ] [ 5.133306 4.977378 3.451883 ] [ 3.497867 4.079859 4.731393 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.930378e-10 5.180054e-10 2.851976e-10 ] [ 5.738994e-10 3.052967000000001e-10 1.218676e-10 ] [ 3.217774e-10 2.94037e-10 2.40806e-10 ] [ 5.439965e-10 2.572298e-10 3.526756e-10 ] [ 4.050256e-10 4.656384e-10 1.057411e-10 ] [ 5.133306e-10 4.977378e-10 3.451883e-10 ] [ 3.497867e-10 4.079859e-10 4.731393e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 105.2979136 -112.7380673 -2.7837857 ] [ 1.1115982 -23.7079446 -37.7941446 ] [ 41.5453944 117.8482001 -14.5997887 ] [ 10.4531969 17.5968839 -28.6474623 ] [ -56.9917602 -44.7508378 95.866607 ] [ -99.7703254 -35.5177951 65.9378 ] [ -1.6460174 81.2695608 -77.9792256 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.687058567788708e-07 -1.806262971903795e-07 -4.460116402603333e-09 ] [ 1.780976662436459e-09 -3.798431487828648e-08 -6.055289538013727e-08 ] [ 6.656306015799444e-08 1.888136325591765e-07 -2.339144031647723e-08 ] [ 1.674786782378123e-08 2.819331621579079e-08 -4.589829472045589e-08 ] [ -9.131086652297117e-08 -7.169874667508397e-08 1.535952377162608e-07 ] [ -1.598496841224567e-07 -5.690578140041969e-08 1.056440024573652e-07 ] [ -2.637210617437432e-09 1.302081913692023e-07 -1.249364931937346e-07 ] ] } "relaxed-potential-energy" { "source-value" -33.64110727636717 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.389899602008286e-18 } }