{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.5793425e-10 1.2023746e-10 -8.677464e-11 ] [ -1.2699e-12 2.4212081e-10 2.1935322e-10 ] [ 2.4815511e-10 1.04508e-11 2.5036943e-10 ] [ 4.713432e-11 2.644548e-11 1.0288939e-10 ] [ 2.9853718e-10 2.8529434e-10 1.412321e-11 ] [ 2.4646897e-10 2.6023225e-10 2.4586795e-10 ] ] "source-value" [ [ 1.5793425 1.2023746 -0.8677464 ] [ -0.012699 2.4212081 2.1935322 ] [ 2.4815511 0.104508 2.5036943 ] [ 0.4713432 0.2644548 1.0288939 ] [ 2.9853718 2.8529434 0.1412321 ] [ 2.4646897 2.6023225 2.4586795 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -4.832645341319041e-12 -2.9608223952384e-12 -1.86269053934208e-12 ] [ -6.518135146400641e-12 3.1466748832512e-12 -1.42337370991872e-12 ] [ 4.96658730681792e-12 -4.95729468241728e-12 1.79956478048256e-12 ] [ -1.24072557514752e-12 -1.51389668899392e-12 -1.8352933191264e-12 ] [ 4.12256066298048e-12 3.29215252041984e-12 2.65672927261056e-12 ] [ 3.5023580930688e-12 2.99334658064064e-12 6.64903297632e-13 ] ] "source-value" [ [ -0.0030163 -0.001848 -0.0011626 ] [ -0.0040683 0.001964 -0.0008884 ] [ 0.0030999 -0.0030941 0.0011232 ] [ -0.0007744 -0.0009449 -0.0011455 ] [ 0.0025731 0.0020548 0.0016582 ] [ 0.002186 0.0018683 0.000415 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.246557317660849e-18 "source-value" -14.021908 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 3.258487857633616e-08 -2.331878013226545e-08 -1.211502224460808e-07 ] [ -6.965459590487693e-08 4.288081721936522e-08 6.232338384107584e-08 ] [ 4.090511619076904e-08 -6.755941880327342e-08 7.562779761748744e-08 ] [ -8.064975502679658e-08 -5.7935510259921e-08 -1.404042199291004e-08 ] [ 4.12105710033069e-08 6.47985651936007e-08 -6.444321379456126e-08 ] [ 3.560378516126141e-08 4.113432662227628e-08 6.168267677498882e-08 ] ] "source-value" [ [ 20.3378817 -14.5544379 -75.6160219 ] [ -43.4749796 26.7641012 38.8991969 ] [ 25.5309656 -42.1672729 47.2031589 ] [ -50.3376182 -36.1605016 -8.7633422 ] [ 25.7216155 40.4440836 -40.2222907 ] [ 22.222135 25.6740275 38.499299 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 1.019790001364336e-17 "source-value" 63.650286 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.761721e-10 1.020444e-10 9.010763e-13 ] [ 5.084234e-11 2.183768e-10 2.158754e-10 ] [ 1.862989e-10 5.350959e-11 1.816496e-10 ] [ 5.578759e-11 1.863455e-11 8.245652999999999e-11 ] [ 2.554812e-10 2.767243e-10 4.680195e-11 ] [ 2.723778e-10 2.754915e-10 2.18144e-10 ] ] "source-value" [ [ 1.761721 1.020444 0.009010763 ] [ 0.5084234 2.183768 2.158754 ] [ 1.862989 0.5350959 1.816496 ] [ 0.5578759 0.1863455 0.8245653 ] [ 2.554812 2.767243 0.4680195 ] [ 2.723778 2.754915 2.18144 ] ] } "instance-id" 1 }