{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.144626 2.611578 2.318929 ] [ 1.72687 4.93899 1.794824 ] [ 4.392296 1.543553 2.156587 ] [ 3.81892 4.173373 2.152355 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.144626e-10 2.611578e-10 2.318929e-10 ] [ 1.72687e-10 4.93899e-10 1.794824e-10 ] [ 4.392296e-10 1.543553e-10 2.156587e-10 ] [ 3.81892e-10 4.173373e-10 2.152355e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4575796 -2.020341 0.2219069 ] [ -1.1616397 0.9070455 -0.3321606 ] [ -0.8859966 1.1689114 0.020916 ] [ 2.505216 -0.0556159 0.0893376 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.331233372750157e-10 -3.236943116243693e-09 3.555340471742035e-10 ] [ -1.861151969133126e-09 1.453247094101846e-09 -5.321799476709004e-10 ] [ -1.419523038628289e-09 1.872802516866597e-09 3.35111262006528e-11 ] [ 4.013798505254092e-09 -8.910649472475073e-11 1.431346140783821e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -5.2525489 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.415511047188757e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.7821634 2.3067739 2.2141286 ] [ 2.0047743 4.5476928 1.967724 ] [ 4.0365816 2.0860536 2.2436159 ] [ 4.2591927 4.3269738 1.9972265 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7821634e-10 2.3067739e-10 2.2141286e-10 ] [ 2.0047743e-10 4.5476928e-10 1.967724e-10 ] [ 4.0365816e-10 2.0860536e-10 2.2436159e-10 ] [ 4.2591927e-10 4.3269738e-10 1.9972265e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6e-06 -4.8e-06 -2.4e-06 ] [ 1.2e-05 -1.19e-05 4.3e-06 ] [ -9.8e-06 9.1e-06 1.9e-06 ] [ 3.8e-06 7.6e-06 -3.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.6130597248e-15 -7.69044777984e-15 -3.84522388992e-15 ] [ 1.92261194496e-14 -1.906590178752e-14 6.889359469440001e-15 ] [ -1.570133088384e-14 1.457980724928e-14 3.04413557952e-15 ] [ 6.08827115904e-15 1.217654231808e-14 -6.08827115904e-15 ] ] } "relaxed-potential-energy" { "source-value" -6.4872904 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.039378501122028e-18 } }