{ "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" [ [ 2.051273 2.837998 1.545633 ] [ 2.498541 2.310424 3.735737 ] [ 1.453493 4.519355 3.131974 ] [ 4.173987 2.427158 6.121254 ] [ 4.520065 2.264664 3.31985 ] [ 3.501394 4.313188 2.351729 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.051273e-10 2.837998e-10 1.545633e-10 ] [ 2.498541e-10 2.310424e-10 3.735737e-10 ] [ 1.453493e-10 4.519355e-10 3.131974e-10 ] [ 4.173987e-10 2.427158e-10 6.121254e-10 ] [ 4.520065e-10 2.264664e-10 3.31985e-10 ] [ 3.501394e-10 4.313188e-10 2.351729e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.343024 -5.1956267 -5.7520221 ] [ -4.5189289 -12.6827619 5.9628026 ] [ -6.4966832 5.5091551 6.0558285 ] [ 0.828745 0.751687 -1.0767098 ] [ -1.5575716 1.8094541 2.1008122 ] [ 13.0874627 9.8080925 -7.2907114 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.151761671701216e-09 -8.324311697726526e-09 -9.215755406871609e-09 ] [ -7.240122294287322e-09 -2.032002477076544e-08 9.553462998874447e-09 ] [ -1.040883402154035e-08 8.826639574301931e-09 9.702506922211266e-09 ] [ 1.32779587454433e-09 1.204335347481558e-09 -1.725079283158813e-09 ] [ -2.495504823301994e-09 2.899065079315499e-09 3.365872219262135e-09 ] [ 2.096842693628655e-08 1.571429662761064e-08 -1.168100745031743e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.2093062 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.94840530699133e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.060755 2.7955923 0.8904158 ] [ 1.9059688 1.8700719 3.3498711 ] [ 2.0947202 4.2151187 4.2140571 ] [ 4.0054964 3.4286699 5.8449772 ] [ 4.3866908 2.1442912 3.5790245 ] [ 3.7451219 4.219043 2.3278313 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.060755e-10 2.7955923e-10 8.904158e-11 ] [ 1.9059688e-10 1.8700719e-10 3.3498711e-10 ] [ 2.0947202e-10 4.2151187e-10 4.2140571e-10 ] [ 4.0054964e-10 3.4286699e-10 5.8449772e-10 ] [ 4.3866908e-10 2.1442912e-10 3.5790245e-10 ] [ 3.7451219e-10 4.219043e-10 2.3278313e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.3e-06 1.5e-06 -8e-07 ] [ -6.3e-06 -9.3e-06 2.2e-06 ] [ 7e-07 -9e-07 -1e-07 ] [ 1.6e-06 -4e-06 -6.8e-06 ] [ -1.1e-06 6e-06 1.02e-05 ] [ 7.4e-06 6.7e-06 -4.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.685006258199999e-15 2.403264951e-15 -1.2817413072e-15 ] [ -1.00937127942e-14 -1.49002426962e-14 3.5247885948e-15 ] [ 1.1215236438e-15 -1.4419589706e-15 -1.602176634e-16 ] [ 2.5634826144e-15 -6.408706535999999e-15 -1.08948011112e-14 ] [ -1.7623942974e-15 9.613059803999999e-15 1.63422016668e-14 ] [ 1.18561070916e-14 1.07345834478e-14 -7.530230179799999e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.441499 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.474000889173436e-18 } }