{ "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" [ [ 2.061869 2.942366 1.677644 ] [ 1.882152 2.580028 5.41738 ] [ 1.143094 3.952812 3.395101 ] [ 3.99886 1.876175 2.533949 ] [ 4.004626 1.895608 4.810911 ] [ 3.218518 3.766044 3.544324 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.061869e-10 2.942366e-10 1.677644e-10 ] [ 1.882152e-10 2.580028e-10 5.41738e-10 ] [ 1.143094e-10 3.952812e-10 3.395101e-10 ] [ 3.99886e-10 1.876175e-10 2.533949e-10 ] [ 4.004626e-10 1.895608e-10 4.810911e-10 ] [ 3.218518e-10 3.766044e-10 3.544324e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.7680245 -3.8963804 -9.5504647 ] [ -4.19088 -1.3216923 4.0385751 ] [ -5.128837 1.8110059 2.4069684 ] [ 3.2799923 -4.9767866 -4.576814 ] [ 2.1718372 -2.2587984 2.930286 ] [ 7.6359121 10.6426518 4.7514492 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.037040810239533e-09 -6.242689634055573e-09 -1.530153138618182e-08 ] [ -6.714530011897919e-09 -2.117584520397718e-09 6.470510659874213e-09 ] [ -8.217302800994657e-09 2.90155133701614e-09 3.856388529256365e-09 ] [ 5.255127022759918e-09 -7.973691202924303e-09 -7.332864448964075e-09 ] [ 3.479666814691985e-09 -3.618994017396585e-09 4.694835760137323e-09 ] [ 1.223407994589787e-08 1.705140803775804e-08 7.612660885877992e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.9288115 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.110117988669049e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7363757 2.3394704 1.634222 ] [ 1.7788255 2.3971008 5.3134303 ] [ 1.4575083 3.9422245 3.5950576 ] [ 4.0463087 2.2713541 2.7070801 ] [ 3.4171203 1.339742 4.7515045 ] [ 3.8729806 4.7231413 3.3780144 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7363757e-10 2.3394704e-10 1.634222e-10 ] [ 1.7788255e-10 2.3971008e-10 5.3134303e-10 ] [ 1.4575083e-10 3.9422245e-10 3.5950576e-10 ] [ 4.0463087e-10 2.2713541e-10 2.7070801e-10 ] [ 3.4171203e-10 1.339742e-10 4.7515045e-10 ] [ 3.8729806e-10 4.7231413e-10 3.3780144e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.1e-06 -3.8e-06 1.8e-06 ] [ 7.52e-05 -1.49e-05 -2.74e-05 ] [ -1.77e-05 -2.19e-05 1.25e-05 ] [ 1.62e-05 -2.2e-06 1.39e-05 ] [ -7.99e-05 3.31e-05 -1.2e-06 ] [ 9.3e-06 9.7e-06 5e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.9667475654e-15 -6.088271209199999e-15 2.8839179412e-15 ] [ 1.204836828768e-13 -2.38724318466e-14 -4.389963977159999e-14 ] [ -2.83585264218e-14 -3.50876682846e-14 2.0027207925e-14 ] [ 2.59552614708e-14 -3.5247885948e-15 2.22702552126e-14 ] [ -1.280139130566e-13 5.303204658539999e-14 -1.9226119608e-15 ] [ 1.49002426962e-14 1.55411133498e-14 8.010883169999999e-16 ] ] } "relaxed-potential-energy" { "source-value" -15.314433 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.453642671555852e-18 } }