{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8495841 0.5267621 0.8966685 ] [ 0.1884113 0.623136 2.979456 ] [ 1.483282 2.75051 2.967402 ] [ 1.97645 1.30316 2.052926 ] [ 2.403862 2.938822 1.215589 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.495841e-11 5.267621e-11 8.966685e-11 ] [ 1.884113e-11 6.23136e-11 2.979456e-10 ] [ 1.483282e-10 2.75051e-10 2.967402e-10 ] [ 1.97645e-10 1.30316e-10 2.052926e-10 ] [ 2.403862e-10 2.938822e-10 1.215589e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.2911215 -4.9523095 -7.5241573 ] [ -3.0258937 -0.3185767 2.9126122 ] [ -4.0293526 6.6346499 7.9638357 ] [ 9.1284569 -7.7253255 2.2821988 ] [ 3.2179108 6.3615618 -5.6344894 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.47731123495503e-09 -7.934474565236222e-09 -1.205502901660053e-08 ] [ -4.848016183107806e-09 -5.104161448768277e-10 4.666519210743334e-09 ] [ -6.455734585867148e-09 1.062988104455044e-08 1.275947147555503e-08 ] [ 1.462540034965607e-08 -1.237733600614437e-08 3.656485591502839e-09 ] [ 5.155661494056246e-09 1.019234567170698e-08 -9.027447261200679e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.002454732689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.014816085358109e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.4015259 1.1475419 0.6118995 ] [ 0.5185752 0.6773032 2.944712 ] [ 0.8915214 3.0296224 3.0107099 ] [ 2.8479087 0.7082691 2.4446175 ] [ 2.2420583 2.5796535 1.1001027 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.015259e-11 1.1475419e-10 6.118995000000001e-11 ] [ 5.185752000000001e-11 6.773032e-11 2.944712e-10 ] [ 8.915214e-11 3.0296224e-10 3.0107099e-10 ] [ 2.8479087e-10 7.082691e-11 2.4446175e-10 ] [ 2.2420583e-10 2.5796535e-10 1.1001027e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-07 7.4e-06 -3.3e-06 ] [ -5.2e-06 -6.7e-06 1.99e-05 ] [ -1.48e-05 -2e-07 2e-07 ] [ 3.1e-06 -1e-06 -8.3e-06 ] [ 1.71e-05 4e-07 -8.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.602176634e-16 1.18561070916e-14 -5.2871828922e-15 ] [ -8.331318496799998e-15 -1.07345834478e-14 3.18833150166e-14 ] [ -2.37122141832e-14 -3.204353268e-16 3.204353268e-16 ] [ 4.9667475654e-15 -1.602176634e-15 -1.32980660622e-14 ] [ 2.73972204414e-14 6.408706536e-16 -1.3618501389e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }