{ "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" [ [ 0.2422976 0.2155702 0.7539187 ] [ 0.1069263 2.303076 0.5134626 ] [ 0.4438839 2.233015 2.726304 ] [ 2.36111 0.1695128 0.2725886 ] [ 2.483594 1.001172 2.982027 ] [ 2.63043 2.516837 1.068712 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.422976e-11 2.155702e-11 7.539187e-11 ] [ 1.069263e-11 2.303076e-10 5.134626e-11 ] [ 4.438839e-11 2.233015e-10 2.726304e-10 ] [ 2.36111e-10 1.695128e-11 2.725886e-11 ] [ 2.483594e-10 1.001172e-10 2.982027e-10 ] [ 2.63043e-10 2.516837e-10 1.068712e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.721122 -2.4821198 0.6172149 ] [ -0.9462932 3.1707494 -2.0964377 ] [ 0.9429835 -0.0108699 0.8298917 ] [ 2.2142185 0.3420642 1.6188086 ] [ 0.4428199 -1.1500658 -1.014516 ] [ -0.9326067 0.1302419 0.0450385 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.757541429944538e-09 -3.976794313584772e-09 9.8888728278941e-10 ] [ -1.516128841462018e-09 5.080100559095628e-09 -3.358863469903725e-09 ] [ 1.510826117500157e-09 -1.741549965043392e-11 1.329633079535967e-09 ] [ 3.547569114042845e-09 5.480472640526553e-10 2.593617292469979e-09 ] [ 7.09475691004994e-10 -1.842608537141648e-09 -1.625433816627533e-09 ] [ -1.494200651141439e-09 2.086705272285715e-10 7.21596317359008e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -17.015379 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.726164242785129e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.035915 0.2306547 0.7791794 ] [ 0.0374898 2.7172801 0.2455638 ] [ 0.5253403 1.8886375 2.6549299 ] [ 2.4667438 0.068709 0.626144 ] [ 2.8043013 0.9461597 2.9892374 ] [ 2.3984516 2.5877421 1.0219584 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.5915e-12 2.306547e-11 7.791794e-11 ] [ 3.74898e-12 2.7172801e-10 2.455638e-11 ] [ 5.253403e-11 1.8886375e-10 2.6549299e-10 ] [ 2.4667438e-10 6.870900000000001e-12 6.261440000000001e-11 ] [ 2.8043013e-10 9.461597e-11 2.9892374e-10 ] [ 2.3984516e-10 2.5877421e-10 1.0219584e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.57e-05 -3.86e-05 -5.1e-06 ] [ -2.89e-05 6.24e-05 -1.31e-05 ] [ -2.9e-06 -3.67e-05 -4.01e-05 ] [ 1.19e-05 -3.19e-05 2.76e-05 ] [ 5.41e-05 1.1e-06 3.23e-05 ] [ 2.15e-05 4.36e-05 -1.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.924123777856e-14 -6.184401756288e-14 -8.17110076608e-15 ] [ -4.630290434112001e-14 9.997582113791999e-14 -2.098851373248e-14 ] [ -4.646312200320001e-15 -5.879988198335999e-14 -6.424728249408e-14 ] [ 1.906590178752e-14 -5.110943420352001e-14 4.422007473408001e-14 ] [ 8.667775518528e-14 1.76239428288e-15 5.175030485184e-14 ] [ 3.44467973472e-14 6.985490066688e-14 -2.56348259328e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.321103 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.095581951466875e-18 } }