{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.291373 0.2175772 2.382477 ] [ 0.160359 2.066003 1.905678 ] [ 1.191739 1.933254 2.911087 ] [ 2.962853 1.944071 0.1667647 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.91373e-11 2.175772e-11 2.382477e-10 ] [ 1.60359e-11 2.066003e-10 1.905678e-10 ] [ 1.191739e-10 1.933254e-10 2.911087e-10 ] [ 2.962853e-10 1.944071e-10 1.667647e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.7345429 -35.0583065 -0.5810772 ] [ -67.8701861 26.4774647 -68.5308909 ] [ 75.1195466 8.576017 69.2306597 ] [ 0.4851824 0.0048247 -0.1186917 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.239210380695463e-08 -5.616959903914068e-08 -9.309883047199256e-10 ] [ -1.087400254187651e-07 4.242157492039728e-08 -1.097985912025755e-07 ] [ 1.203547813276161e-07 1.374029393698335e-08 1.109197444139007e-07 ] [ 7.773478981036339e-10 7.730021542373761e-12 -1.901650668230074e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 29.36558 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.704884573223207e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.635209 -0.3501921 2.6428081 ] [ -0.4176913 2.8774846 1.3603141 ] [ 1.4292248 1.9368799 2.6118262 ] [ 2.9595815 1.6967328 0.7510584 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.352090000000001e-11 -3.501921e-11 2.6428081e-10 ] [ -4.176913e-11 2.8774846e-10 1.3603141e-10 ] [ 1.4292248e-10 1.9368799e-10 2.6118262e-10 ] [ 2.9595815e-10 1.6967328e-10 7.510584e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.5e-06 -1.7e-06 -1.6e-06 ] [ 4.4e-06 1.2e-06 -3.9e-06 ] [ -8e-07 1.5e-06 6e-06 ] [ -7.1e-06 -9e-07 -4e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.6076181728e-15 -2.72370025536e-15 -2.56348259328e-15 ] [ 7.04957713152e-15 1.92261194496e-15 -6.24848882112e-15 ] [ -1.28174129664e-15 2.4032649312e-15 9.6130597248e-15 ] [ -1.137545400768e-14 -1.44195895872e-15 -6.408706483200001e-16 ] ] } "relaxed-potential-energy" { "source-value" -9.1265651 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.462236923142922e-18 } }