{ "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" [ [ 0.0900209 0.6645307 1.771827 ] [ 2.257627 0.9336486 1.950206 ] [ 2.208369 3.070111 3.037465 ] [ 1.738494 0.324563 4.412062 ] [ 4.235476 0.6031948 3.631674 ] [ 3.30736 2.214082 5.333714 ] [ 4.556657 2.857436 3.382282 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.002090000000001e-12 6.645307e-11 1.771827e-10 ] [ 2.257627e-10 9.336486e-11 1.950206e-10 ] [ 2.208369e-10 3.070111e-10 3.037465e-10 ] [ 1.738494e-10 3.24563e-11 4.412062e-10 ] [ 4.235476000000001e-10 6.031948e-11 3.631674e-10 ] [ 3.30736e-10 2.214082e-10 5.333714e-10 ] [ 4.556657000000001e-10 2.857436e-10 3.382282e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5002647 -0.3871158 -0.2836723 ] [ 1.99896 -1.0858588 2.7530862 ] [ -2.1779563 0.6371495 1.4228533 ] [ 4.8590559 2.9132979 -1.3618978 ] [ -3.5310438 -5.2350517 -1.1450257 ] [ -6.097797 -1.8859364 2.6206926 ] [ 6.4490459 5.0435153 -4.0060365 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.40368904715502e-09 -6.202278894122172e-10 -4.544931307730382e-10 ] [ 3.202687004300639e-09 -1.739737597183279e-09 4.41093038102785e-09 ] [ -3.489470693733094e-09 1.020826041264783e-09 2.279662310869792e-09 ] [ 7.78506582627984e-09 4.667617823261268e-09 -2.182000833056005e-09 ] [ -5.657355869990568e-09 -8.387477511521977e-09 -1.834533421869493e-09 ] [ -9.769747872275296e-09 -3.021603233290077e-09 4.198812448616708e-09 ] [ 1.03325106525735e-08 8.0806023668815e-09 -6.41837807525114e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -21.26183 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.406520722208022e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.1562571 0.5862623 1.3552557 ] [ 2.0124071 0.8348728 2.2286456 ] [ 2.3414318 3.0899104 3.0622591 ] [ 1.9072288 0.2198066 4.6472157 ] [ 4.1898897 0.6487496 3.5157114 ] [ 3.2422954 2.22898 5.2645654 ] [ 4.8570082 3.0589843 3.4455771 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.562571e-11 5.862623e-11 1.3552557e-10 ] [ 2.0124071e-10 8.348728e-11 2.2286456e-10 ] [ 2.3414318e-10 3.0899104e-10 3.0622591e-10 ] [ 1.9072288e-10 2.198066e-11 4.6472157e-10 ] [ 4.1898897e-10 6.487496000000001e-11 3.5157114e-10 ] [ 3.2422954e-10 2.22898e-10 5.264565400000001e-10 ] [ 4.8570082e-10 3.0589843e-10 3.4455771e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.75e-05 -2.7e-06 -1.18e-05 ] [ 4.7e-06 3.7e-06 4.13e-05 ] [ 7.81e-05 -2.68e-05 5.78e-05 ] [ 4.51e-05 6.97e-05 -2.35e-05 ] [ 1.92e-05 -2.1e-05 -4.9e-06 ] [ -3.89e-05 -8.7e-06 -7.25e-05 ] [ -9.07e-05 -1.41e-05 1.36e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.8038091095e-14 -4.3258769118e-15 -1.89056842812e-14 ] [ 7.530230179799999e-15 5.9280535458e-15 6.61698949842e-14 ] [ 1.251299951154e-13 -4.293833379119999e-14 9.26058094452e-14 ] [ 7.225816619339999e-14 1.116717113898e-13 -3.765115089899999e-14 ] [ 3.076179137279999e-14 -3.364570931399999e-14 -7.850665506599998e-15 ] [ -6.232467106259999e-14 -1.39389367158e-14 -1.16157805965e-13 ] [ -1.453174207038e-13 -2.25906905394e-14 2.17896022224e-14 ] ] } "relaxed-potential-energy" { "source-value" -23.386205 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.746883120893397e-18 } }