{ "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" [ [ 2.55675 2.192965 3.527099 ] [ 1.806278 5.26626 2.450306 ] [ 0.8031725 3.384297 2.630387 ] [ 2.570894 3.149532 1.167105 ] [ 2.627788 4.286276 4.286712 ] [ 4.842075 2.861339 2.293967 ] [ 3.90768 5.002934 2.246314 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.55675e-10 2.192965e-10 3.527099e-10 ] [ 1.806278e-10 5.26626e-10 2.450306e-10 ] [ 8.031725e-11 3.384297e-10 2.630387e-10 ] [ 2.570894e-10 3.149532e-10 1.167105e-10 ] [ 2.627788e-10 4.286276e-10 4.286712e-10 ] [ 4.842075000000001e-10 2.861339e-10 2.293967e-10 ] [ 3.90768e-10 5.002934e-10 2.246314e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.9830255 -2.4317601 0.9256655 ] [ -3.266288 5.6328242 -0.8549961 ] [ -5.4446802 -2.3880684 -0.8702451 ] [ 1.2362245 -2.2959421 -3.9145052 ] [ 1.9973607 0.8697757 4.9947087 ] [ -0.7429057 -0.6090254 0.4283098 ] [ 4.2372632 1.2221961 -0.7089375 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.17715709455023e-09 -3.89610917961427e-09 1.483079622781142e-09 ] [ -5.233170270399591e-09 9.024779242316465e-09 -1.369854762295179e-09 ] [ -8.723339324172668e-09 -3.826107359351263e-09 -1.394286353585758e-09 ] [ 1.98064999196017e-09 -3.678504755330456e-09 -6.271728713440028e-09 ] [ 3.200124616844723e-09 1.393534291879955e-09 8.002405506846362e-09 ] [ -1.190266143999059e-09 -9.757662573533683e-10 6.862279480195238e-10 ] [ 6.788844035216195e-09 1.958174017452939e-09 -1.1358430881084e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.416322 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.82909642039247e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5554565 2.3743145 3.8462127 ] [ 1.4955609 5.2822465 2.7868113 ] [ 1.0796918 3.1043918 2.2429721 ] [ 2.7669685 3.3118619 0.7192229 ] [ 3.0297318 4.5233005 4.453411 ] [ 4.3010917 2.5529276 2.38586 ] [ 3.8861362 4.9945601 2.1673999 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5554565e-10 2.3743145e-10 3.8462127e-10 ] [ 1.4955609e-10 5.282246500000001e-10 2.7868113e-10 ] [ 1.0796918e-10 3.1043918e-10 2.2429721e-10 ] [ 2.7669685e-10 3.3118619e-10 7.192229e-11 ] [ 3.0297318e-10 4.5233005e-10 4.453411e-10 ] [ 4.3010917e-10 2.5529276e-10 2.38586e-10 ] [ 3.8861362e-10 4.994560100000001e-10 2.1673999e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.9e-06 -1.6e-06 -1.81e-05 ] [ 1.7e-06 7.4e-06 -7.7e-06 ] [ 1.9e-05 -4e-06 2.67e-05 ] [ -1.1e-05 1.14e-05 -2.08e-05 ] [ -1.43e-05 1.58e-05 7.8e-06 ] [ 6.2e-06 2.43e-05 -3e-07 ] [ 2e-07 -5.33e-05 1.23e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.04413557952e-15 -2.56348259328e-15 -2.899939683648e-14 ] [ 2.72370025536e-15 1.185610699392e-14 -1.233675998016e-14 ] [ 3.04413557952e-14 -6.4087064832e-15 4.277811577536e-14 ] [ -1.76239428288e-14 1.826481347712e-14 -3.332527371264e-14 ] [ -2.291112567744e-14 2.531439060864e-14 1.249697764224e-14 ] [ 9.93349504896e-15 3.893289188544e-14 -4.8065298624e-16 ] [ 3.2043532416e-16 -8.539601388864e-14 1.970677243584e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.445632 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.314445386308035e-18 } }