{ "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" [ [ 2.04098 2.133134 3.812884 ] [ 2.161605 4.797503 2.926814 ] [ 2.748178 3.149118 1.513672 ] [ 4.833213 2.247647 2.725743 ] [ 4.087134 1.710162 4.852625 ] [ 4.720686 4.556589 2.507622 ] [ 3.429181 3.830938 4.469304 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.04098e-10 2.133134e-10 3.812884e-10 ] [ 2.161605e-10 4.797503e-10 2.926814e-10 ] [ 2.748178e-10 3.149118e-10 1.513672e-10 ] [ 4.833213e-10 2.247647e-10 2.725743e-10 ] [ 4.087134e-10 1.710162e-10 4.852625e-10 ] [ 4.720686e-10 4.556589e-10 2.507622e-10 ] [ 3.429181e-10 3.830938e-10 4.469304000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.6079234 -0.1850704 -1.5868052 ] [ -2.2344905 2.0359095 -0.5211008 ] [ 1.2411521 -2.1505306 -0.6575217 ] [ 1.4532411 -0.7998586 -1.1982424 ] [ 1.0649756 -2.9989111 1.5543185 ] [ -0.9002642 1.4418644 -0.669268 ] [ 2.9833093 2.6565967 3.0786196 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.780530568741835e-09 -2.965154705250336e-10 -2.542342214149697e-09 ] [ -3.580048467994977e-09 3.261886629838622e-09 -8.348955257187071e-10 ] [ 1.988544893860032e-09 -3.445529878022e-09 -1.053465904087958e-09 ] [ 2.328348933988457e-09 -1.281514759423952e-09 -1.919795975148081e-09 ] [ 1.70627902210013e-09 -4.804785291863237e-09 2.490292782493929e-09 ] [ -1.442382265666703e-09 2.310121451076429e-09 -1.072285551483912e-09 ] [ 4.779788452454897e-09 4.256337158701508e-09 4.932492388094426e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.233534 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.241769539804455e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8788356 2.4260942 3.784782 ] [ 2.0915832 4.7366258 2.9233087 ] [ 2.9238011 2.8515179 1.5522714 ] [ 5.0399661 2.1236479 2.4910157 ] [ 4.0598265 1.7246217 4.5850361 ] [ 4.5359674 4.4940013 2.6198696 ] [ 3.4909972 4.0685822 4.8523805 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8788356e-10 2.4260942e-10 3.784782e-10 ] [ 2.0915832e-10 4.7366258e-10 2.9233087e-10 ] [ 2.9238011e-10 2.8515179e-10 1.5522714e-10 ] [ 5.0399661e-10 2.1236479e-10 2.4910157e-10 ] [ 4.0598265e-10 1.7246217e-10 4.5850361e-10 ] [ 4.5359674e-10 4.4940013e-10 2.6198696e-10 ] [ 3.4909972e-10 4.0685822e-10 4.8523805e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4e-06 -5e-06 7.8e-06 ] [ -2.3e-06 4.8e-06 -3.6e-06 ] [ 3.5e-06 3.1e-06 3.7e-06 ] [ 7e-07 1.03e-05 -2.6e-06 ] [ -8.6e-06 1.8e-06 1.3e-06 ] [ 0.0 -9.9e-06 2.1e-06 ] [ 2.7e-06 -5.1e-06 -8.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.408706535999999e-15 -8.010883169999999e-15 1.24969777452e-14 ] [ -3.685006258199999e-15 7.690447843199998e-15 -5.767835882399999e-15 ] [ 5.607618218999999e-15 4.9667475654e-15 5.9280535458e-15 ] [ 1.1215236438e-15 1.65024193302e-14 -4.165659248399999e-15 ] [ -1.37787190524e-14 2.8839179412e-15 2.0828296242e-15 ] [ 0.0 -1.58615486766e-14 3.364570931399999e-15 ] [ 4.3258769118e-15 -8.1711008334e-15 -1.39389367158e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.563325 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.615043210034805e-18 } }