{ "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" [ [ 2.570437 1.678388 2.565083 ] [ 2.924882 3.183881 4.210831 ] [ 1.144354 3.791418 3.165706 ] [ 4.144212 1.310941 0.7169232 ] [ 4.636642 2.415393 2.866782 ] [ 3.821758 3.649635 1.198039 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.570437e-10 1.678388e-10 2.565083e-10 ] [ 2.924882e-10 3.183881e-10 4.210831e-10 ] [ 1.144354e-10 3.791418000000001e-10 3.165706e-10 ] [ 4.144212e-10 1.310941e-10 7.169232e-11 ] [ 4.636642e-10 2.415393e-10 2.866782e-10 ] [ 3.821758e-10 3.649635e-10 1.198039e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.1430717 -11.9876152 0.1768292 ] [ -0.16195 2.6200959 5.7285578 ] [ -1.9260822 3.549422 -0.8549165 ] [ 0.8538212 -4.6944555 -5.1923771 ] [ 9.0280844 1.3268275 4.8957157 ] [ 0.3491984 9.1857254 -4.7538092 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.304663920672666e-08 -1.920627697082324e-08 2.833116124489127e-10 ] [ -2.594725058763e-10 4.1978564298192e-09 9.178161453678443e-09 ] [ -3.085923896003314e-09 5.686800992605547e-09 -1.369727240321061e-09 ] [ 1.36797237625384e-09 -7.521346911452787e-09 -8.319105264536681e-09 ] [ 1.446458587545991e-08 2.125812017848635e-09 7.843801301246953e-09 ] [ 5.594775171101855e-10 1.47171546022203e-08 -7.616442022734232e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.8404098 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.357368114544612e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.1249158 0.6036466 2.816267 ] [ 2.9048128 2.6219511 4.0366348 ] [ 1.6347391 4.3910254 2.8414911 ] [ 4.1321582 0.8739783 1.2326354 ] [ 4.8036896 2.8776942 2.5384843 ] [ 3.6419696 4.6613605 1.2578517 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1249158e-10 6.036466e-11 2.816267e-10 ] [ 2.9048128e-10 2.6219511e-10 4.0366348e-10 ] [ 1.6347391e-10 4.391025400000001e-10 2.8414911e-10 ] [ 4.1321582e-10 8.739783e-11 1.2326354e-10 ] [ 4.803689600000001e-10 2.8776942e-10 2.5384843e-10 ] [ 3.6419696e-10 4.6613605e-10 1.2578517e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.45e-05 1e-07 -6e-06 ] [ -8.5e-06 3.6e-06 2.8e-06 ] [ 1.9e-06 9e-06 5e-07 ] [ -1.02e-05 -9.6e-06 -1.5e-06 ] [ -7.3e-06 -4.4e-06 2.7e-06 ] [ -4e-07 1.2e-06 1.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.925332753299999e-14 1.602176634e-16 -9.613059803999999e-15 ] [ -1.3618501389e-14 5.767835882399999e-15 4.486094575199999e-15 ] [ 3.0441356046e-15 1.4419589706e-14 8.010883169999999e-16 ] [ -1.63422016668e-14 -1.53808956864e-14 -2.403264951e-15 ] [ -1.16958894282e-14 -7.0495771896e-15 4.3258769118e-15 ] [ -6.408706536e-16 1.9226119608e-15 2.2430472876e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.959351 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.396752263200453e-18 } }