{ "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" [ [ 0.5308739 0.2525778 2.81745 ] [ 0.4737551 1.568741 0.832487 ] [ 2.312512 2.941662 0.559243 ] [ 2.76942 1.516894 1.016982 ] [ 2.535548 1.814472 2.698768 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.308739e-11 2.525778e-11 2.81745e-10 ] [ 4.737551e-11 1.568741e-10 8.32487e-11 ] [ 2.312512e-10 2.941662e-10 5.592430000000001e-11 ] [ 2.76942e-10 1.516894e-10 1.016982e-10 ] [ 2.535548e-10 1.814472e-10 2.698768e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4761895 0.35041 0.7762668 ] [ -8.4077474 -5.7333441 15.0727449 ] [ 5.7935997 29.2984533 -29.3408061 ] [ 17.8494871 -8.7344402 -2.4707976 ] [ -15.711529 -15.181079 15.962592 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.629396839704416e-10 5.61418709694528e-10 1.243716518463229e-09 ] [ -1.347069631787199e-08 -9.185829876021618e-09 2.414919949006243e-08 ] [ 9.282369989613893e-09 4.69412969028606e-08 -4.700915356884603e-08 ] [ 2.859803092489119e-08 -1.399411588421568e-08 -3.95865414944875e-09 ] [ -2.51726444408212e-08 -2.432276985231785e-08 2.557489170976911e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 1.3170033 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.110071896776449e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.0962464 0.9459822 3.0900978 ] [ 0.8840919 1.1971228 0.8175261 ] [ 1.7593892 3.2904178 -0.019311 ] [ 3.408382 1.9889962 1.1448492 ] [ 2.4739995 0.6718278 2.8917678 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.62464e-12 9.459822000000001e-11 3.0900978e-10 ] [ 8.840919e-11 1.1971228e-10 8.175261000000001e-11 ] [ 1.7593892e-10 3.290417800000001e-10 -1.9311e-12 ] [ 3.408382e-10 1.9889962e-10 1.1448492e-10 ] [ 2.4739995e-10 6.718278e-11 2.891767800000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.03e-05 9.62e-05 -0.0001327 ] [ -0.0001391 -6.14e-05 -2.57e-05 ] [ -0.000142 3.66e-05 2.99e-05 ] [ 0.0002195 1.34e-05 -9.1e-06 ] [ 2.13e-05 -8.48e-05 0.0001375 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.456771781824e-14 1.5412939092096e-13 -2.1260883758016e-13 ] [ -2.2286276795328e-13 -9.837364451712e-14 -4.117593915456e-14 ] [ -2.275090801536e-13 5.863966432128e-14 4.790508096192e-14 ] [ 3.516777682656e-13 2.146916671872e-14 -1.457980724928e-14 ] [ 3.412636202304e-14 -1.3586457744384e-13 2.2029928536e-13 ] ] } "relaxed-potential-energy" { "source-value" -15.983578 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.560851498833322e-18 } }