{ "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" [ [ 2.428537 1.662164 2.065612 ] [ 2.677805 2.654077 4.303636 ] [ 2.380622 3.799595 2.643621 ] [ 4.65403 2.78928 1.862185 ] [ 4.978196 2.955414 4.623231 ] [ 4.975087 5.409268 1.773954 ] [ 3.793479 4.953224 3.972917 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.428537e-10 1.662164e-10 2.065612e-10 ] [ 2.677805e-10 2.654077e-10 4.303636e-10 ] [ 2.380622e-10 3.799595e-10 2.643621e-10 ] [ 4.65403e-10 2.78928e-10 1.862185e-10 ] [ 4.978196e-10 2.955414e-10 4.623231e-10 ] [ 4.975087000000001e-10 5.409268e-10 1.773954e-10 ] [ 3.793479e-10 4.953223999999999e-10 3.972917e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1765509 -4.5274628 -1.7919682 ] [ -1.0435126 -7.5765794 8.6397167 ] [ -3.5346094 7.939423 -8.2066137 ] [ 0.8755319 8.1649754 -0.3544336 ] [ 1.5911565 -0.4269917 0.3661198 ] [ -2.7785098 -8.7852627 4.0478208 ] [ 4.7133925 5.2118982 -2.7006419 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.828657266916706e-10 -7.253795109464215e-09 -2.871049578911038e-09 ] [ -1.671891505004588e-09 -1.213901848032574e-08 1.384235222111959e-08 ] [ -5.663068590996759e-09 1.272035801804218e-08 -1.314844471440428e-08 ] [ 1.402756752501625e-09 1.30817328030648e-08 -5.678652322245025e-10 ] [ 2.549313765337221e-09 -6.841161246519377e-10 5.865885888047531e-10 ] [ -4.451663478900013e-09 -1.407554262149175e-08 6.485323904379186e-09 ] [ 7.551687330370844e-09 8.350381514826658e-09 -4.326905348981364e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.443724 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.833486719874502e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7922012 1.9883715 1.9368386 ] [ 2.7982708 1.9638723 4.4396784 ] [ 1.9534235 3.9749363 3.2043819 ] [ 4.6472896 2.8291443 0.8054319 ] [ 4.3693712 3.5009695 5.3672457 ] [ 5.3208623 4.8126037 1.7986298 ] [ 4.0063375 5.1531245 3.6929497 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7922012e-10 1.9883715e-10 1.9368386e-10 ] [ 2.7982708e-10 1.9638723e-10 4.4396784e-10 ] [ 1.9534235e-10 3.9749363e-10 3.2043819e-10 ] [ 4.6472896e-10 2.8291443e-10 8.054319000000001e-11 ] [ 4.3693712e-10 3.5009695e-10 5.3672457e-10 ] [ 5.3208623e-10 4.8126037e-10 1.7986298e-10 ] [ 4.0063375e-10 5.1531245e-10 3.6929497e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.1e-06 -1.02e-05 6.1e-06 ] [ 8e-06 -3.3e-06 7.4e-06 ] [ -1.32e-05 9e-06 -1.45e-05 ] [ 1.4e-06 1.23e-05 5e-07 ] [ -2.2e-06 -7.3e-06 -9e-07 ] [ -1.4e-06 -6.6e-06 -3.4e-06 ] [ 8.5e-06 6.1e-06 4.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.7623942974e-15 -1.63422016668e-14 9.773277467399999e-15 ] [ 1.2817413072e-14 -5.2871828922e-15 1.18561070916e-14 ] [ -2.11487315688e-14 1.4419589706e-14 -2.3231561193e-14 ] [ 2.2430472876e-15 1.97067725982e-14 8.010883169999999e-16 ] [ -3.5247885948e-15 -1.16958894282e-14 -1.4419589706e-15 ] [ -2.2430472876e-15 -1.05743657844e-14 -5.4474005556e-15 ] [ 1.3618501389e-14 9.773277467399999e-15 7.690447843199998e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.179115 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.912615327979891e-18 } }