{ "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" [ [ 1.302275 0.3737398 2.647818 ] [ 0.2826825 1.480501 1.727575 ] [ 0.6414777 2.53008 2.452953 ] [ 2.763361 0.4669357 0.177905 ] [ 2.062003 2.101671 0.3497139 ] [ 2.601995 2.989286 1.853157 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.302275e-10 3.737398e-11 2.647818e-10 ] [ 2.826825e-11 1.480501e-10 1.727575e-10 ] [ 6.414777000000001e-11 2.53008e-10 2.452953e-10 ] [ 2.763361e-10 4.669357e-11 1.77905e-11 ] [ 2.062003e-10 2.101671e-10 3.497139e-11 ] [ 2.601995e-10 2.989286e-10 1.853157e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 12.0330956 -24.4228992 14.5077407 ] [ -46.9584668 -68.6517599 -63.8363371 ] [ 22.2833197 88.4210555 59.0109076 ] [ 10.5168941 -20.1173281 -5.6459758 ] [ -8.4243457 7.9182473 -20.8789251 ] [ 10.5495032 16.8526844 16.8425898 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.927914444617135e-08 -3.912979811039502e-08 2.324396297016863e-08 ] [ -7.523575765557297e-08 -1.09992244688555e-07 -1.022770868591277e-07 ] [ 3.570181385715207e-08 1.416661479085592e-07 9.454589652890904e-08 ] [ 1.684992185044946e-08 -3.223151275478289e-08 -9.045850428362578e-09 ] [ -1.349728972607701e-08 1.268643070177272e-08 -3.345172566265431e-08 ] [ 1.690216738809479e-08 2.700097694340088e-08 2.698480361128454e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 39.624055 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.348473454229335e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6171914 -0.0188421 2.4887768 ] [ -0.0738993 1.406943 1.3523019 ] [ 0.5434251 3.1210168 2.9805111 ] [ 2.983916 0.1335345 0.4592147 ] [ 1.7896343 2.1960979 -0.0790474 ] [ 2.7935267 3.1034634 2.0073649 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6171914e-10 -1.88421e-12 2.4887768e-10 ] [ -7.38993e-12 1.406943e-10 1.3523019e-10 ] [ 5.434251e-11 3.1210168e-10 2.980511100000001e-10 ] [ 2.983916e-10 1.335345e-11 4.592147e-11 ] [ 1.7896343e-10 2.1960979e-10 -7.904740000000001e-12 ] [ 2.7935267e-10 3.1034634e-10 2.0073649e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.6e-06 -1.02e-05 8.2e-06 ] [ -2e-05 -6.1e-06 3.8e-06 ] [ 1.03e-05 -2.9e-06 -5e-06 ] [ -2.9e-06 6.4e-06 9e-06 ] [ 1.06e-05 1.52e-05 -1.5e-05 ] [ -1.6e-06 -2.5e-06 -1.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.76783583488e-15 -1.634220153216e-14 1.313784829056e-14 ] [ -3.2043532416e-14 -9.77327738688e-15 6.08827115904e-15 ] [ 1.650241919424e-14 -4.646312200320001e-15 -8.010883104e-15 ] [ -4.646312200320001e-15 1.025393037312e-14 1.44195895872e-14 ] [ 1.698307218048e-14 2.435308463616e-14 -2.4032649312e-14 ] [ -2.56348259328e-15 -4.005441552e-15 -1.76239428288e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.572951 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.334844138826398e-18 } }