{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.301375 1.527111 2.019819 ] [ 1.794175 5.106546 1.47688 ] [ 0.9503771 3.237781 1.232452 ] [ 3.392468 3.669062 0.7528338 ] [ 3.101246 3.595776 2.776891 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.301375e-10 1.527111e-10 2.019819e-10 ] [ 1.794175e-10 5.106546e-10 1.47688e-10 ] [ 9.503771e-11 3.237781e-10 1.232452e-10 ] [ 3.392468e-10 3.669062e-10 7.528338e-11 ] [ 3.101246e-10 3.595776e-10 2.776891e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2142666 -3.2544195 0.3184968 ] [ -1.3825536 10.0043423 0.5631112 ] [ -7.8056622 -5.3775462 -1.9067715 ] [ 6.8482319 -1.1291247 -11.2668593 ] [ 2.1257173 -0.2432518 12.2920228 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.432929399666244e-10 -5.214154880133962e-09 5.102881309637711e-10 ] [ -2.215095073172582e-09 1.602872347159782e-08 9.022036069837008e-10 ] [ -1.250604958973704e-08 -8.615778869895491e-09 -3.054984743677131e-09 ] [ 1.097207713439342e-08 -1.80905721121226e-09 -1.80514987090256e-08 ] [ 3.405774588549568e-09 -3.897323501384411e-10 1.969399171475525e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.1464465 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.24551633043108e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.2753328 1.9009091 1.7389992 ] [ 1.8043908 4.8585324 1.4612483 ] [ 0.2312598 3.0590101 1.2516319 ] [ 3.8735349 3.5806187 0.6303081 ] [ 3.3551229 3.7372056 3.1766883 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2753328e-10 1.9009091e-10 1.7389992e-10 ] [ 1.8043908e-10 4.8585324e-10 1.4612483e-10 ] [ 2.312598e-11 3.0590101e-10 1.2516319e-10 ] [ 3.8735349e-10 3.5806187e-10 6.303081e-11 ] [ 3.3551229e-10 3.7372056e-10 3.1766883e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-07 -1.9e-06 3.5e-06 ] [ 4.8e-06 -3e-06 -2.1e-06 ] [ -1.9e-06 1e-06 1.7e-06 ] [ -3e-07 6.5e-06 4.1e-06 ] [ -2.5e-06 -2.6e-06 -7.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.602176634e-16 -3.0441356046e-15 5.607618218999999e-15 ] [ 7.690447843199998e-15 -4.806529901999999e-15 -3.364570931399999e-15 ] [ -3.0441356046e-15 1.602176634e-15 2.7237002778e-15 ] [ -4.806529901999999e-16 1.0414148121e-14 6.568924199399999e-15 ] [ -4.005441585e-15 -4.165659248399999e-15 -1.15356717648e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.750145 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.722363113111193e-18 } }