{ "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" [ [ 1.175063 2.090387 1.108777 ] [ 2.290473 2.943113 3.7458 ] [ 1.562387 4.346014 1.227002 ] [ 3.205072 1.346551 2.036178 ] [ 4.414518 1.768723 4.119804 ] [ 3.44377 3.554925 2.238453 ] [ 4.008705 3.851776 5.027783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.175063e-10 2.090387e-10 1.108777e-10 ] [ 2.290473e-10 2.943113e-10 3.7458e-10 ] [ 1.562387e-10 4.346014000000001e-10 1.227002e-10 ] [ 3.205072e-10 1.346551e-10 2.036178e-10 ] [ 4.414518e-10 1.768723e-10 4.119804e-10 ] [ 3.44377e-10 3.554925e-10 2.238453e-10 ] [ 4.008705e-10 3.851776e-10 5.027783000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4289991 -0.5926927 0.46185 ] [ -9.6401966 -3.4453569 7.1599727 ] [ -2.3222642 3.7694578 -0.5217296 ] [ 1.671326 -6.2943037 -0.2146686 ] [ 0.963257 -1.4577994 -0.4244456 ] [ 9.0906849 5.9642153 -7.0262552 ] [ 0.666192 2.0564795 0.5652763 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.873323340270294e-10 -9.495983950823716e-10 7.399652784128999e-10 ] [ -1.544529773968624e-08 -5.520070320970674e-09 1.147154096001789e-08 ] [ -3.720677439214702e-09 6.039337210009045e-09 -8.359029743861663e-10 ] [ 2.677759464996684e-09 -1.008458631543974e-08 -3.439370149734923e-10 ] [ 1.543307857936938e-09 -2.335652135739219e-09 -6.800368227241103e-10 ] [ 1.456488293383662e-08 9.5557263938053e-09 -1.125730190596099e-08 ] [ 1.067357256157728e-09 3.294843403200003e-09 9.05672479613974e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -16.275779 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.607667281394788e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5852272 2.3345823 1.0549074 ] [ 1.9157533 2.6714175 3.6476262 ] [ 1.4451873 4.557661 1.9585375 ] [ 3.1749955 0.8822667 2.1972815 ] [ 4.3880107 1.8627006 4.0705046 ] [ 3.7618056 3.4365407 2.0515789 ] [ 3.8290084 4.15632 4.5233608 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5852272e-10 2.3345823e-10 1.0549074e-10 ] [ 1.9157533e-10 2.6714175e-10 3.6476262e-10 ] [ 1.4451873e-10 4.557661000000001e-10 1.9585375e-10 ] [ 3.1749955e-10 8.822667e-11 2.1972815e-10 ] [ 4.3880107e-10 1.8627006e-10 4.0705046e-10 ] [ 3.761805600000001e-10 3.4365407e-10 2.0515789e-10 ] [ 3.8290084e-10 4.15632e-10 4.5233608e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.23e-05 3.47e-05 -3.87e-05 ] [ 4.39e-05 -2.64e-05 -1.55e-05 ] [ -4.24e-05 7.4e-06 -2.64e-05 ] [ -4.62e-05 -7.8e-06 8.08e-05 ] [ 1.31e-05 5.38e-05 -4.98e-05 ] [ -1.48e-05 -1.28e-05 3.25e-05 ] [ 1.42e-05 -4.89e-05 1.71e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.17503052782e-14 5.55955291998e-14 -6.200423573579999e-14 ] [ 7.03355542326e-14 -4.22974631376e-14 -2.4833737827e-14 ] [ -6.79322892816e-14 1.18561070916e-14 -4.22974631376e-14 ] [ -7.40205604908e-14 -1.24969777452e-14 1.294558720272e-13 ] [ 2.09885139054e-14 8.619710290919999e-14 -7.978839637319999e-14 ] [ -2.37122141832e-14 -2.05078609152e-14 5.207074060499999e-14 ] [ 2.27509082028e-14 -7.834643740259999e-14 2.73972204414e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.225347 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.400675501194199e-18 } }