{ "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" [ [ 2.176849 1.681974 3.211274 ] [ 2.864727 5.809081 2.248654 ] [ 2.905691 3.612446 1.71083 ] [ 4.50356 2.090932 1.710731 ] [ 5.648677 2.904188 3.876429 ] [ 4.83518 4.522991 2.188517 ] [ 3.438619 4.083879 4.381538 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.176849e-10 1.681974e-10 3.211274e-10 ] [ 2.864727e-10 5.809081e-10 2.248654e-10 ] [ 2.905691e-10 3.612446e-10 1.71083e-10 ] [ 4.503560000000001e-10 2.090932e-10 1.710731e-10 ] [ 5.648677e-10 2.904188e-10 3.876429e-10 ] [ 4.835180000000001e-10 4.522991000000001e-10 2.188517e-10 ] [ 3.438619e-10 4.083879e-10 4.381538e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 8.7438751 10.6003089 54.0022201 ] [ -29.0610748 21.9123495 70.2149917 ] [ -70.4431704 -5.0971332 -105.6850281 ] [ 36.1164257 -26.2208767 7.2216139 ] [ 3.3089711 -10.7287442 -3.0279167 ] [ 110.738759 6.9348838 -35.7925276 ] [ -59.4037857 2.599212 13.0666468 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.400923226041526e-08 1.698356709283817e-08 8.652109451551584e-08 ] [ -4.656097461988003e-08 3.510745407569857e-08 1.124968181314061e-07 ] [ -1.128624007099106e-07 -8.166507646143491e-09 -1.69326081190411e-07 ] [ 5.786489288340027e-08 -4.201047562561946e-08 1.157030095502431e-08 ] [ 5.30155613532286e-09 -1.71893431277836e-08 -4.851257346469887e-09 ] [ 1.774230506862056e-07 1.111090869232466e-08 -5.734595092005873e-08 ] [ -9.517535663555336e-08 4.16439669890281e-09 2.093507601521113e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 31.289776 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.013174757726894e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1649252 1.9570319 3.2078559 ] [ 2.9533768 5.6672529 2.8437921 ] [ 2.5018574 3.6186641 0.9300272 ] [ 4.6600497 1.6884705 1.8792122 ] [ 5.652343 3.2534174 4.0308147 ] [ 5.2905265 4.655305 1.5881008 ] [ 3.1502244 3.8653491 4.8481701 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1649252e-10 1.9570319e-10 3.2078559e-10 ] [ 2.9533768e-10 5.667252900000001e-10 2.8437921e-10 ] [ 2.5018574e-10 3.6186641e-10 9.300272000000001e-11 ] [ 4.660049700000001e-10 1.6884705e-10 1.8792122e-10 ] [ 5.652343e-10 3.2534174e-10 4.0308147e-10 ] [ 5.290526500000001e-10 4.655305000000001e-10 1.5881008e-10 ] [ 3.1502244e-10 3.8653491e-10 4.8481701e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.1e-05 -2.04e-05 1.33e-05 ] [ 1.39e-05 -2.27e-05 7.6e-06 ] [ 4.05e-05 1.7e-06 1.62e-05 ] [ -1.55e-05 4.19e-05 1.46e-05 ] [ -1.56e-05 -9.1e-06 -1.25e-05 ] [ -1.03e-05 3.2e-06 -1.95e-05 ] [ -2e-06 5.4e-06 -1.97e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.76239428288e-14 -3.268440306432e-14 2.130894905664e-14 ] [ 2.227025502912e-14 -3.636940929216e-14 1.217654231808e-14 ] [ 6.488815314240001e-14 2.72370025536e-15 2.595526125696e-14 ] [ -2.48337376224e-14 6.713120041152e-14 2.339177866368e-14 ] [ -2.499395528448e-14 -1.457980724928e-14 -2.002720776e-14 ] [ -1.650241919424e-14 5.126965186560001e-15 -3.12424441056e-14 ] [ -3.2043532416e-15 8.65175375232e-15 -3.156287942976e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.651734 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.148554877298047e-18 } }