{ "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" [ [ -1.0482877 -0.3590683 0.0060593 ] [ 0.8524316 0.6561136 1.5854399 ] [ 0.6864114 -0.5884853 -0.2867482 ] [ 1.3343012 1.0270482 -0.5365135 ] [ -0.5836363 -1.1716677 -0.572745 ] [ -1.5542003 -0.6255997 0.2168524 ] [ 0.3129801 1.0616591 -0.4123448 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.679542044812204e-09 -5.752908355304007e-10 9.708068798413441e-12 ] [ 1.365745980351137e-09 1.051209870508923e-09 2.540154741463489e-09 ] [ 1.099752297330597e-09 -9.428573893444742e-10 -4.594212620964826e-10 ] [ 2.137786187745385e-09 1.645512614474723e-09 -8.595893864435807e-10 ] [ -9.350884349102152e-10 -1.877218596286508e-09 -9.17638648680096e-10 ] [ -2.490103384700346e-09 -1.002321213319494e-09 3.474358454443699e-10 ] [ 5.014493989956461e-10 1.700965389279569e-09 -6.606491982684518e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -19.117482 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.062958270896483e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.4728347 0.908999 2.0143224 ] [ 1.7821786 0.9910326 2.0815472 ] [ 2.5339388 3.0997762 2.6725261 ] [ 2.6066111 0.1496674 4.1001614 ] [ 4.8772356 0.4734558 3.8384721 ] [ 2.4564364 2.298755 5.0027089 ] [ 4.6104382 2.74588 3.8094918 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.728347e-11 9.08999e-11 2.0143224e-10 ] [ 1.7821786e-10 9.910326000000001e-11 2.0815472e-10 ] [ 2.5339388e-10 3.0997762e-10 2.6725261e-10 ] [ 2.6066111e-10 1.496674e-11 4.1001614e-10 ] [ 4.8772356e-10 4.734558e-11 3.838472100000001e-10 ] [ 2.4564364e-10 2.298755e-10 5.0027089e-10 ] [ 4.6104382e-10 2.74588e-10 3.8094918e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.17e-05 2.57e-05 -1.9e-06 ] [ -2.55e-05 -2.58e-05 -1.8e-06 ] [ -5.3e-06 1.11e-05 1.55e-05 ] [ 9.3e-06 -1.59e-05 2.48e-05 ] [ 1.27e-05 1.2e-06 -7.5e-06 ] [ -8.5e-06 -1e-06 -3.39e-05 ] [ -4.5e-06 4.7e-06 4.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.476723267136e-14 4.117593915456e-14 -3.04413557952e-15 ] [ -4.08555038304e-14 -4.133615681664e-14 -2.88391791744e-15 ] [ -8.491536090240001e-15 1.778416049088e-14 2.48337376224e-14 ] [ 1.490024257344e-14 -2.547460827072e-14 3.973398019584e-14 ] [ 2.034764308416e-14 1.92261194496e-15 -1.2016324656e-14 ] [ -1.36185012768e-14 -1.6021766208e-15 -5.431378744512e-14 ] [ -7.2097947936e-15 7.53023011776e-15 7.69044777984e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.113945 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.382826905185706e-18 } }