{ "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" [ [ 1.899847 1.906187 1.523281 ] [ 1.884769 1.70171 3.709853 ] [ 2.49478 3.91064 2.644859 ] [ 3.453021 0.2240813 2.013003 ] [ 4.505277 2.817941 2.046258 ] [ 4.372743 1.259433 3.808578 ] [ 3.775648 3.545824 4.38804 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.899847e-10 1.906187e-10 1.523281e-10 ] [ 1.884769e-10 1.70171e-10 3.709853e-10 ] [ 2.49478e-10 3.91064e-10 2.644859e-10 ] [ 3.453021e-10 2.240813e-11 2.013003e-10 ] [ 4.505277e-10 2.817941e-10 2.046258e-10 ] [ 4.372743e-10 1.259433e-10 3.808578e-10 ] [ 3.775648e-10 3.545824e-10 4.38804e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.9315391 -4.4131453 -14.6836984 ] [ -25.0638019 -9.8403987 18.7533065 ] [ -6.9595927 19.8186972 -5.23778 ] [ 3.7366672 -18.4935481 -10.0054191 ] [ 24.735832 10.4814555 -17.5239695 ] [ 11.9872419 -10.7428446 10.1476093 ] [ 5.4951927 13.189784 18.5499513 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.232078623778107e-08 -7.070638223853402e-09 -2.352587828335837e-08 ] [ -4.015663743254262e-08 -1.576605673649071e-08 3.004610923699668e-08 ] [ -1.115049671423035e-08 3.175305330855442e-08 -8.391848660893824e-09 ] [ 5.986800827550198e-09 -2.962993040146026e-08 -1.603044856332578e-08 ] [ 3.96311717264365e-08 1.679314295405557e-08 -2.807649423651227e-08 ] [ 1.920567872005418e-08 -1.721193445900753e-08 1.625826237747265e-08 ] [ 8.804269270730828e-09 2.113236355820191e-08 2.972029828983857e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 10.057756 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.611430152091092e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6442369 1.8524506 1.9617124 ] [ 1.2953593 2.3132065 4.2550969 ] [ 2.8105267 3.7412938 1.1458364 ] [ 3.3767422 0.247452 2.0687981 ] [ 4.9662645 3.5416121 2.1046323 ] [ 4.841859 1.5562679 3.3839052 ] [ 3.4510964 2.1135333 5.2138906 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6442369e-10 1.8524506e-10 1.9617124e-10 ] [ 1.2953593e-10 2.3132065e-10 4.2550969e-10 ] [ 2.8105267e-10 3.7412938e-10 1.1458364e-10 ] [ 3.3767422e-10 2.47452e-11 2.0687981e-10 ] [ 4.966264500000001e-10 3.5416121e-10 2.1046323e-10 ] [ 4.841859000000001e-10 1.5562679e-10 3.3839052e-10 ] [ 3.4510964e-10 2.1135333e-10 5.2138906e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.47e-05 2.29e-05 9.4e-06 ] [ -1.94e-05 -1.03e-05 -2.65e-05 ] [ 5.4e-06 -5.6e-06 -7.7e-06 ] [ 1.46e-05 -1.78e-05 7.6e-06 ] [ 2.32e-05 2.87e-05 -1.96e-05 ] [ 4.1e-06 -6.5e-06 1.2e-06 ] [ 1.68e-05 -1.14e-05 3.55e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.161729494976001e-14 3.668984461632e-14 1.506046023552e-14 ] [ -3.108222644352e-14 -1.650241919424e-14 -4.24576804512e-14 ] [ 8.65175375232e-15 -8.972189076479999e-15 -1.233675998016e-14 ] [ 2.339177866368e-14 -2.851874385024e-14 1.217654231808e-14 ] [ 3.717049760256e-14 4.598246901696e-14 -3.140266176767999e-14 ] [ 6.568924145279999e-15 -1.04141480352e-14 1.92261194496e-15 ] [ 2.691656722944e-14 -1.826481347712e-14 5.68772700384e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.037353 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.889902527771674e-18 } }