{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.845445 0.9973996 1.833851 ] [ 2.258239 2.496991 3.58031 ] [ 1.78294 4.270758 1.69672 ] [ 2.678494 4.477221 3.72616 ] [ 4.64173 2.41566 3.489752 ] [ 3.528967 5.47506 1.628646 ] [ 3.443776 3.131475 0.8054665 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.845445e-10 9.973996000000001e-11 1.833851e-10 ] [ 2.258239e-10 2.496991e-10 3.58031e-10 ] [ 1.78294e-10 4.270758e-10 1.69672e-10 ] [ 2.678494e-10 4.477221e-10 3.72616e-10 ] [ 4.64173e-10 2.41566e-10 3.489752e-10 ] [ 3.528967e-10 5.475060000000001e-10 1.628646e-10 ] [ 3.443776e-10 3.131475e-10 8.054665e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.0535572 1.9239369 0.6963635 ] [ -0.4352048 -3.4817196 0.0208366 ] [ -3.3310225 -0.7697524 -0.3642444 ] [ 1.8185333 2.7467686 1.1806056 ] [ -2.1855399 0.0936292 -1.2291403 ] [ 1.7567477 1.1327125 0.1208217 ] [ 1.322929 -1.6455753 -0.4252428 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.687984728422465e-09 3.082486746470394e-09 1.115697328470459e-09 ] [ -6.972749615646431e-10 -5.578329789259825e-09 3.33839136520044e-11 ] [ -5.336886416828264e-09 -1.233279309245422e-09 -5.835838667453496e-10 ] [ 2.913611561410912e-09 4.400808469924891e-09 1.89153870628955e-09 ] [ -3.501620960454697e-09 1.500105165001128e-10 -1.96929986856775e-09 ] [ 2.814620116773242e-09 1.814805500539725e-09 1.935777046201578e-10 ] [ 2.119565932240986e-09 -2.63650229514754e-09 -6.813140779367351e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -19.949301 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.196230392683283e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0029923 1.3611749 2.2962983 ] [ 1.5525071 2.7955258 3.4074545 ] [ 1.4533536 3.8780414 1.354584 ] [ 3.380543 4.1524871 4.0259891 ] [ 4.8192677 2.7093918 2.9108709 ] [ 3.2696128 5.2262837 1.9691474 ] [ 3.7013145 3.1416598 0.7965613 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0029923e-10 1.3611749e-10 2.2962983e-10 ] [ 1.5525071e-10 2.7955258e-10 3.4074545e-10 ] [ 1.4533536e-10 3.8780414e-10 1.354584e-10 ] [ 3.380543e-10 4.1524871e-10 4.0259891e-10 ] [ 4.8192677e-10 2.7093918e-10 2.9108709e-10 ] [ 3.2696128e-10 5.2262837e-10 1.9691474e-10 ] [ 3.7013145e-10 3.1416598e-10 7.965613e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.6e-06 -2.1e-06 -1e-07 ] [ -7e-06 1.07e-05 -8.2e-06 ] [ -1.06e-05 -1.2e-06 8.2e-06 ] [ -2.1e-06 -6e-07 4.6e-06 ] [ 7e-06 -5.5e-06 -3.5e-06 ] [ -7e-07 1.9e-06 -1.2e-06 ] [ 5.8e-06 -3.2e-06 1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.21765424184e-14 -3.364570931399999e-15 -1.602176634e-16 ] [ -1.1215236438e-14 1.71432899838e-14 -1.31378483988e-14 ] [ -1.69830723204e-14 -1.9226119608e-15 1.31378483988e-14 ] [ -3.364570931399999e-15 -9.613059803999998e-16 7.370012516399999e-15 ] [ 1.1215236438e-14 -8.811971486999999e-15 -5.607618218999999e-15 ] [ -1.1215236438e-15 3.0441356046e-15 -1.9226119608e-15 ] [ 9.2926244772e-15 -5.1269652288e-15 1.602176634e-16 ] ] } "relaxed-potential-energy" { "source-value" -22.96247 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.678993289292598e-18 } }