{ "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" [ [ 2.03068 2.305251 2.057253 ] [ 2.579116 2.417689 4.578894 ] [ 0.1076423 2.252956 3.524492 ] [ 1.371288 4.166573 3.55215 ] [ 3.675708 3.460848 3.322007 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.03068e-10 2.305251e-10 2.057253e-10 ] [ 2.579116e-10 2.417689e-10 4.578894e-10 ] [ 1.076423e-11 2.252956e-10 3.524492e-10 ] [ 1.371288e-10 4.166573e-10 3.55215e-10 ] [ 3.675708000000001e-10 3.460848e-10 3.322007e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.2888907 -4.0405379 -14.0084224 ] [ -4.6551255 -12.2727908 24.8629268 ] [ -8.6514224 -3.9772422 0.4930869 ] [ -6.5123235 11.38292 2.6109794 ] [ 17.5299808 8.9076509 -13.9585708 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.667207197319904e-09 -6.473655412171428e-09 -2.24439670484822e-08 ] [ -7.458333304437566e-09 -1.966317865373016e-08 3.983480037181239e-08 ] [ -1.38611068201442e-08 -6.372244520598754e-09 7.900123097114945e-10 ] [ -1.04338925447491e-08 1.823744845069128e-08 4.18325018653534e-09 ] [ 2.808612563222863e-08 1.427163013580907e-08 -2.236409597979469e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -0.76265071 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.22190114746551e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.0269049 1.6625738 1.9129872 ] [ 3.7766929 2.1740496 5.3630132 ] [ -0.2009624 2.8608444 2.4421154 ] [ 1.0372018 4.5622845 3.9425509 ] [ 3.124597 3.3435647 3.3741293 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0269049e-10 1.6625738e-10 1.9129872e-10 ] [ 3.7766929e-10 2.1740496e-10 5.3630132e-10 ] [ -2.009624e-11 2.8608444e-10 2.4421154e-10 ] [ 1.0372018e-10 4.5622845e-10 3.9425509e-10 ] [ 3.124597e-10 3.3435647e-10 3.3741293e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4e-07 -1.07e-05 -2.49e-05 ] [ 1.75e-05 2.53e-05 -5.6e-06 ] [ -6.3e-06 2.11e-05 -5e-07 ] [ -2.29e-05 1.2e-06 -1.4e-06 ] [ 1.21e-05 -3.69e-05 3.23e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.408706536e-16 -1.71432899838e-14 -3.989419818659999e-14 ] [ 2.8038091095e-14 4.053506884019999e-14 -8.972189150399999e-15 ] [ -1.00937127942e-14 3.38059269774e-14 -8.010883169999999e-16 ] [ -3.66898449186e-14 1.9226119608e-15 -2.2430472876e-15 ] [ 1.93863372714e-14 -5.91203177946e-14 5.17503052782e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.90107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.227196954159838e-18 } }