{ "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" [ [ 0.1446516 0.7602583 1.64121 ] [ 0.5863284 2.091282 0.4918312 ] [ 1.988461 0.5220119 2.855455 ] [ 2.293973 2.837851 0.0455476 ] [ 2.215952 2.17866 2.777134 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.446516e-11 7.602583e-11 1.64121e-10 ] [ 5.863284e-11 2.091282e-10 4.918312e-11 ] [ 1.988461e-10 5.220119e-11 2.855455e-10 ] [ 2.293973e-10 2.837851e-10 4.55476e-12 ] [ 2.215952e-10 2.17866e-10 2.777134e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.3155447 -13.1001561 10.9245118 ] [ -7.3615542 9.4999101 -10.3138428 ] [ -3.1024028 -29.4662529 2.5714197 ] [ 10.1966066 3.4494148 0.4467449 ] [ 4.5828951 29.617084 -3.6288336 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.914264824357351e-09 -2.098876383225051e-08 1.750299739961372e-08 ] [ -1.179451003199205e-08 1.522053386192179e-08 -1.652459780476641e-08 ] [ -4.970597234464458e-09 -4.72101414989602e-08 4.11986852560455e-09 ] [ 1.633676470601498e-08 5.526571748001507e-09 7.15764234241634e-10 ] [ 7.342607384798878e-09 4.745179956106975e-08 -5.814032354693499e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.69774775 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.117915132265803e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.0092471 0.3900089 1.6070623 ] [ 0.307923 2.0005242 0.0371378 ] [ 1.6959778 0.5594258 3.1149935 ] [ 2.1793008 3.1652271 0.5747553 ] [ 3.0369172 2.2748772 2.4772289 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.2471e-13 3.900089e-11 1.6070623e-10 ] [ 3.07923e-11 2.0005242e-10 3.71378e-12 ] [ 1.6959778e-10 5.594258e-11 3.1149935e-10 ] [ 2.1793008e-10 3.1652271e-10 5.747553e-11 ] [ 3.0369172e-10 2.2748772e-10 2.4772289e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.62e-05 1.5e-06 -3.14e-05 ] [ -2e-07 -3.39e-05 8.3e-06 ] [ 2.65e-05 2.51e-05 4.97e-05 ] [ 2.38e-05 5.55e-05 2.25e-05 ] [ -3.38e-05 -4.83e-05 -4.92e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.595526125696e-14 2.4032649312e-15 -5.030834589312e-14 ] [ -3.2043532416e-16 -5.431378744512e-14 1.329806595264e-14 ] [ 4.24576804512e-14 4.021463318208e-14 7.962817805376001e-14 ] [ 3.813180357504e-14 8.892080245440001e-14 3.604897396800001e-14 ] [ -5.415356978304e-14 -7.738513078464e-14 -7.882708974336e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.332164 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.296265808627141e-18 } }