{ "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" [ [ 1.235296 0.1194615 1.060663 ] [ 0.5951279 1.958954 0.23753 ] [ 0.7849876 2.237774 2.150251 ] [ 2.634784 1.158802 0.6457174 ] [ 2.006718 1.111823 2.877883 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.235296e-10 1.194615e-11 1.060663e-10 ] [ 5.951279e-11 1.958954e-10 2.3753e-11 ] [ 7.849876000000001e-11 2.237774e-10 2.150251e-10 ] [ 2.634784e-10 1.158802e-10 6.457174e-11 ] [ 2.006718e-10 1.111823e-10 2.877883e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.4143415 -31.2573124 -6.0106088 ] [ -8.7336055 8.0517762 -12.914927 ] [ -15.6121679 23.73673 12.5203422 ] [ 23.7935795 4.3445431 -11.682151 ] [ 10.9665354 -4.8757369 18.0873446 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.668561460979651e-08 -5.007973556891845e-08 -9.630056975474779e-09 ] [ -1.399277866267388e-08 1.290036768983731e-08 -2.069199426921572e-08 ] [ -2.501345061546484e-08 3.803043417356682e-08 2.005979972252415e-08 ] [ 3.812151711412139e-08 6.960725440225924e-09 -1.871686936705973e-08 ] [ 1.757032677381384e-08 -7.811791734711594e-09 2.897912088922608e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -2.1798250463688493 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.492464755500137e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.8945948 0.0195729 1.2528748 ] [ 0.6221751 1.8682934 -0.0914554 ] [ 0.7409475 2.3177194 2.1375669 ] [ 2.7119468 1.5532526 0.7742294 ] [ 2.2872493 0.8279762 2.8988288 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.945948e-11 1.95729e-12 1.2528748e-10 ] [ 6.221751e-11 1.8682934e-10 -9.145540000000001e-12 ] [ 7.409475e-11 2.3177194e-10 2.1375669e-10 ] [ 2.7119468e-10 1.5532526e-10 7.742294e-11 ] [ 2.2872493e-10 8.279762000000001e-11 2.8988288e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.052234 -0.1121976 0.0073965 ] [ -0.051561 0.0084748 -0.0897755 ] [ -0.0432296 0.0920572 0.0818853 ] [ 0.1294307 0.0430074 -0.0341068 ] [ 0.017594 -0.0313418 0.0346005 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.3688094300356e-11 -1.797603731108784e-10 1.1850499473381e-11 ] [ -8.2609829425674e-11 1.35781265378232e-11 -1.43836208405667e-10 ] [ -6.92614550171664e-11 1.474918948314648e-10 1.311947143280802e-10 ] [ 2.073708432622638e-10 6.89054513690916e-11 -5.46451180205112e-11 ] [ 2.818869569859599e-11 -5.02150996275012e-11 5.543611262471699e-11 ] ] } "relaxed-potential-energy" { "source-value" -12.92324704636885 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.070532445310168e-18 } }