{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.41976 2.173724 1.743633 ] [ 1.73064 2.628356 3.804992 ] [ 2.229685 4.150034 1.946802 ] [ 3.641834 1.485515 2.800746 ] [ 4.113003 2.080099 4.963049 ] [ 4.173975 3.620344 3.169433 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.41976e-10 2.173724e-10 1.743633e-10 ] [ 1.73064e-10 2.628356e-10 3.804992e-10 ] [ 2.229685e-10 4.150034e-10 1.946802e-10 ] [ 3.641834e-10 1.485515e-10 2.800746e-10 ] [ 4.113003e-10 2.080099e-10 4.963049e-10 ] [ 4.173975000000001e-10 3.620344e-10 3.169433e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6536791 -3.0694659 -2.4784449 ] [ 0.8832721 0.7417517 2.920276 ] [ 0.859229 2.2270178 0.4663353 ] [ -0.6809115 -1.4026625 -1.3058931 ] [ -0.6906846 0.263384 0.3952339 ] [ 0.2827741 1.2399749 0.0024927 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.047309371525585e-09 -4.917826503322831e-09 -3.970906474720994e-09 ] [ 1.41515790842492e-09 1.188417232178655e-09 4.678797933483341e-09 ] [ 1.376636615713363e-09 3.56807585326545e-09 7.471515151137543e-10 ] [ -1.090940486133859e-09 -2.24731306437288e-09 -2.092271394084036e-09 ] [ -1.1065987184666e-09 4.219876870927872e-10 6.332345143276052e-10 ] [ 4.530540519877612e-10 1.986658795158818e-09 3.99374566266816e-12 ] ] } "unrelaxed-potential-energy" { "source-value" -6.305212930490679 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.010206474639802e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6620587 1.640844 2.6095175 ] [ 1.816664 3.4878699 4.086577 ] [ 2.4695115 3.7247606 1.8205703 ] [ 3.9529699 1.8914839 2.0563066 ] [ 3.3001216 1.6545998 4.3223131 ] [ 4.1075712 3.7385138 3.5333706 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6620587e-10 1.640844e-10 2.6095175e-10 ] [ 1.816664e-10 3.4878699e-10 4.086577e-10 ] [ 2.4695115e-10 3.7247606e-10 1.8205703e-10 ] [ 3.9529699e-10 1.8914839e-10 2.0563066e-10 ] [ 3.3001216e-10 1.6545998e-10 4.3223131e-10 ] [ 4.1075712e-10 3.738513800000001e-10 3.5333706e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.22e-05 8.6e-06 -2.93e-05 ] [ -3.04e-05 3.33e-05 1.08e-05 ] [ 3.4e-06 -2.08e-05 -6e-06 ] [ -3.37e-05 3.36e-05 1.57e-05 ] [ 2.38e-05 -5.21e-05 3.57e-05 ] [ 1.47e-05 -2.6e-06 -2.69e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.556832098176e-14 1.377871893888e-14 -4.694377498944e-14 ] [ -4.870616927232e-14 5.335248147264001e-14 1.730350750464e-14 ] [ 5.44740051072e-15 -3.332527371264e-14 -9.6130597248e-15 ] [ -5.399335212096e-14 5.383313445888e-14 2.515417294656e-14 ] [ 3.813180357504e-14 -8.347340194367999e-14 5.719770536256001e-14 ] [ 2.355199632576e-14 -4.16565921408e-15 -4.309855109952001e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.32264193049068 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.333434232432195e-18 } }