{ "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" [ [ 2.271696 2.59158 0.2830491 ] [ 1.885666 2.994299 3.04756 ] [ 2.618377 0.6246748 1.626494 ] [ 2.195128 4.700519 1.092758 ] [ 3.86025 2.803257 1.694059 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.271696e-10 2.59158e-10 2.830491e-11 ] [ 1.885666e-10 2.994299e-10 3.04756e-10 ] [ 2.618377e-10 6.246748e-11 1.626494e-10 ] [ 2.195128e-10 4.700519e-10 1.092758e-10 ] [ 3.86025e-10 2.803257e-10 1.694059e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.2590527 -1.8532874 1.1277688 ] [ 4.3850766 -0.3042777 -8.1910319 ] [ 0.7298378 8.4570778 -0.8816154 ] [ 1.9146196 -6.4497065 2.8424442 ] [ -2.7704812 0.1501939 5.1024343 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.823754662695116e-09 -2.969293743903218e-09 1.806884805027671e-09 ] [ 7.025667208937153e-09 -4.875066171707962e-10 -1.3123479810407e-08 ] [ 1.169329060136106e-09 1.35497323314467e-08 -1.41250358241724e-09 ] [ 3.067558760845448e-09 -1.03335689653218e-08 4.55409764316856e-09 ] [ -4.43880020700593e-09 2.406371551667731e-10 8.175000944628013e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.473309 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.280185703021423e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0417476 2.5439788 0.3942466 ] [ 1.8176148 2.8251763 2.5882057 ] [ 2.7075697 0.95928 1.7918237 ] [ 2.4248759 4.5264523 1.3057442 ] [ 3.8393089 2.8594423 1.6638998 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0417476e-10 2.5439788e-10 3.942466e-11 ] [ 1.8176148e-10 2.8251763e-10 2.5882057e-10 ] [ 2.7075697e-10 9.592800000000001e-11 1.7918237e-10 ] [ 2.4248759e-10 4.5264523e-10 1.3057442e-10 ] [ 3.8393089e-10 2.8594423e-10 1.6638998e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.7e-06 5.3e-05 1.68e-05 ] [ 1.1e-06 3.1e-06 -1.49e-05 ] [ 2.13e-05 -3.16e-05 1.76e-05 ] [ 2.65e-05 -4.86e-05 -7.7e-06 ] [ -5.16e-05 2.41e-05 -1.19e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.32587687616e-15 8.49153609024e-14 2.691656722944e-14 ] [ 1.76239428288e-15 4.96674752448e-15 -2.387243164992e-14 ] [ 3.412636202304e-14 -5.062878121728e-14 2.819830852608e-14 ] [ 4.24576804512e-14 -7.786578377088e-14 -1.233675998016e-14 ] [ -8.267231363328e-14 3.861245656128e-14 -1.906590178752e-14 ] ] } "relaxed-potential-energy" { "source-value" -28.867458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.625076630952593e-18 } }