{ "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" [ [ -0.7224006 -0.1330291 -2.9086756 ] [ -0.5373881 -0.4084737 2.9935886 ] [ -1.5873457 1.8725805 -2.4250559 ] [ -0.4058014 -1.0556261 -1.0428338 ] [ 0.744764 0.4886984 -0.7425442 ] [ 1.3340495 0.0528807 1.5931267 ] [ 1.1741224 -0.8170307 2.5323942 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.15741336170758e-09 -2.131361156620494e-10 -4.66021208220593e-09 ] [ -8.609906572096554e-10 -6.544470177435257e-10 4.796257706728772e-09 ] [ -2.543208190620374e-09 3.000204722384037e-09 -3.88536789912384e-09 ] [ -6.501655211244875e-10 -1.691299471660547e-09 -1.670803947505429e-09 ] [ 1.193243478644376e-09 7.829811575531855e-10 -1.189686966952223e-09 ] [ 2.137382937499383e-09 8.472422192956379e-11 2.552470373741528e-09 ] [ 1.881151474736001e-09 -1.309027496800664e-09 4.057342815317123e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.449812 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.315115115209281e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7489549 1.7610966 2.5573967 ] [ -0.4668557 1.3954716 3.0310546 ] [ 2.9296929 3.7862991 2.8093253 ] [ 3.48901 0.2007033 2.704252 ] [ 4.8720111 3.3802256 1.4294163 ] [ 5.3478478 1.6178052 3.013429 ] [ 4.465424 3.2242148 4.588998 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7489549e-10 1.7610966e-10 2.5573967e-10 ] [ -4.668557e-11 1.3954716e-10 3.0310546e-10 ] [ 2.9296929e-10 3.7862991e-10 2.8093253e-10 ] [ 3.48901e-10 2.007033e-11 2.704252e-10 ] [ 4.8720111e-10 3.3802256e-10 1.4294163e-10 ] [ 5.347847800000001e-10 1.6178052e-10 3.013429e-10 ] [ 4.465424e-10 3.2242148e-10 4.588998e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6e-07 -1.8e-06 -9.7e-06 ] [ 9.4e-06 7e-07 -9e-07 ] [ 2.4e-06 -1.03e-05 6.2e-06 ] [ -1.02e-05 -1.18e-05 6.1e-06 ] [ 4.1e-06 9.3e-06 -9.6e-06 ] [ -1.26e-05 2.7e-06 -6.3e-06 ] [ 6.3e-06 1.12e-05 1.42e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.613059803999998e-16 -2.8839179412e-15 -1.55411133498e-14 ] [ 1.50604603596e-14 1.1215236438e-15 -1.4419589706e-15 ] [ 3.845223921599999e-15 -1.65024193302e-14 9.9334951308e-15 ] [ -1.63422016668e-14 -1.89056842812e-14 9.773277467399999e-15 ] [ 6.568924199399999e-15 1.49002426962e-14 -1.53808956864e-14 ] [ -2.01874255884e-14 4.3258769118e-15 -1.00937127942e-14 ] [ 1.00937127942e-14 1.79443783008e-14 2.27509082028e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.490038 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.802213021137209e-18 } }