{ "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" [ [ 1.201304 1.645112 1.368441 ] [ 2.96083 0.196256 2.000233 ] [ 1.817638 2.196428 3.68098 ] [ 1.740873 3.89811 0.9150282 ] [ 4.00836 2.276208 0.7214657 ] [ 3.949621 2.27126 3.236775 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.201304e-10 1.645112e-10 1.368441e-10 ] [ 2.96083e-10 1.96256e-11 2.000233e-10 ] [ 1.817638e-10 2.196428e-10 3.68098e-10 ] [ 1.740873e-10 3.89811e-10 9.150282e-11 ] [ 4.00836e-10 2.276208e-10 7.214657e-11 ] [ 3.949621e-10 2.27126e-10 3.236775e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.3838205 0.7515102 0.3375986 ] [ 0.7333725 4.1011339 1.2156479 ] [ -1.8117354 -0.9542313 -2.767332 ] [ 2.3138612 -2.251314 1.204674 ] [ -5.0920884 -0.4448077 2.7467713 ] [ 1.4727696 -1.2022912 -2.7373597 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.819301473283767e-09 1.204052072732732e-09 5.408925841348109e-10 ] [ 1.174992273837648e-09 6.570740853350325e-09 1.947682644504616e-09 ] [ -2.902720100955737e-09 -1.528847079695591e-09 -4.433754632391706e-09 ] [ 3.707214318416233e-09 -3.607002656879731e-09 1.930100518485619e-09 ] [ -8.158424985526878e-09 -7.126604976918201e-10 4.400812759544423e-09 ] [ 2.359637020944968e-09 -1.926282852033577e-09 -4.385733714060102e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.223264 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.919688753546629e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2315871 1.5577903 1.0135608 ] [ 3.0109794 0.3911512 2.3297142 ] [ 1.6843267 2.1242957 3.281602 ] [ 2.2152304 3.7699739 1.6445984 ] [ 3.5418795 2.0368252 0.692705 ] [ 3.9946228 2.6033377 2.9607425 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2315871e-10 1.5577903e-10 1.0135608e-10 ] [ 3.0109794e-10 3.911512e-11 2.3297142e-10 ] [ 1.6843267e-10 2.1242957e-10 3.281602e-10 ] [ 2.2152304e-10 3.7699739e-10 1.6445984e-10 ] [ 3.5418795e-10 2.0368252e-10 6.92705e-11 ] [ 3.9946228e-10 2.6033377e-10 2.9607425e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.52e-05 -3.99e-05 1.62e-05 ] [ 3.9e-06 -6.43e-05 -1.22e-05 ] [ -2.83e-05 4.6e-06 -3e-06 ] [ -1.46e-05 6.74e-05 -2.58e-05 ] [ 5.88e-05 2.14e-05 -1.5e-06 ] [ 5.52e-05 1.07e-05 2.62e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.2048368188416e-13 -6.392684716992e-14 2.595526125696e-14 ] [ 6.24848882112e-15 -1.0301995671744e-13 -1.954655477376e-14 ] [ -4.534159836864e-14 7.370012455680001e-15 -4.8065298624e-15 ] [ -2.339177866368e-14 1.0798670424192e-13 -4.133615681664e-14 ] [ 9.420798530304e-14 3.428657968511999e-14 -2.4032649312e-15 ] [ 8.844014946816001e-14 1.714328984256e-14 4.197702746496e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.062777 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.855281874092396e-18 } }