{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.982478 1.406412 2.920232 ] [ 1.664708 2.759694 5.087468 ] [ 1.282886 3.129979 1.519732 ] [ 2.3658 4.253432 3.372825 ] [ 3.481612 3.001234 2.026348 ] [ 4.008994 2.747584 4.108071 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.982478e-10 1.406412e-10 2.920232e-10 ] [ 1.664708e-10 2.759694e-10 5.087468e-10 ] [ 1.282886e-10 3.129979e-10 1.519732e-10 ] [ 2.3658e-10 4.253432e-10 3.372825e-10 ] [ 3.481612e-10 3.001234e-10 2.026348e-10 ] [ 4.008994e-10 2.747584e-10 4.108071e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1543963 0.1955379 1.7734748 ] [ 0.7966243 -0.772507 -0.8550988 ] [ -1.0272189 0.2418777 -0.0883563 ] [ -1.8101233 2.3296014 1.3820176 ] [ 2.8251237 -0.8973553 -4.4081866 ] [ -0.9388021 -1.0971548 2.1961494 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.47370142198023e-10 3.132862518603283e-10 2.841419862137956e-09 ] [ 1.276332829021165e-09 -1.237692654804346e-09 -1.370019305834135e-09 ] [ -1.645786106023893e-09 3.875307960328762e-10 -1.41562398160391e-10 ] [ -2.900137232025345e-09 3.732432898862949e-09 2.214236288254126e-09 ] [ 4.526347143007993e-09 -1.43772168221097e-09 -7.062693510643841e-09 ] [ -1.504126776177944e-09 -1.7578357699585e-09 3.518619224463948e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.220514 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.040771789535909e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0550361 1.4330247 3.0366989 ] [ 1.7165063 2.7134472 5.0494584 ] [ 1.274833 3.1652924 1.5548707 ] [ 2.2727726 4.3680232 3.3886712 ] [ 3.586578 2.959745 1.8387126 ] [ 3.8807519 2.6588026 4.1662641 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0550361e-10 1.4330247e-10 3.0366989e-10 ] [ 1.7165063e-10 2.7134472e-10 5.0494584e-10 ] [ 1.274833e-10 3.1652924e-10 1.5548707e-10 ] [ 2.2727726e-10 4.3680232e-10 3.3886712e-10 ] [ 3.586578e-10 2.959745e-10 1.8387126e-10 ] [ 3.8807519e-10 2.6588026e-10 4.1662641e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.9e-06 1.12e-05 1.16e-05 ] [ -4.4e-06 -1.06e-05 -2.33e-05 ] [ 7.6e-06 -1.43e-05 2.12e-05 ] [ 1.7e-05 -3.2e-06 -1.22e-05 ] [ -8.1e-06 1.74e-05 9.8e-06 ] [ -4.3e-06 -4e-07 -7.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.265719530432e-14 1.794437815296e-14 1.858524880128e-14 ] [ -7.04957713152e-15 -1.698307218048e-14 -3.733071526464e-14 ] [ 1.217654231808e-14 -2.291112567744e-14 3.396614436096001e-14 ] [ 2.72370025536e-14 -5.126965186560001e-15 -1.954655477376e-14 ] [ -1.297763062848e-14 2.787787320192e-14 1.570133088384e-14 ] [ -6.889359469440001e-15 -6.408706483200001e-16 -1.153567166976e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.320379 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.216989588439529e-18 } }