{ "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" [ [ 0.7826629 0.079664 0.3147899 ] [ 0.4004832 1.295186 0.8087518 ] [ 0.7320587 0.6290848 2.788823 ] [ 1.344916 2.662801 0.2560168 ] [ 0.3963272 2.667865 2.000738 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.826629000000001e-11 7.9664e-12 3.147899e-11 ] [ 4.004832e-11 1.295186e-10 8.087518e-11 ] [ 7.320586999999999e-11 6.290848000000001e-11 2.788823e-10 ] [ 1.344916e-10 2.662801e-10 2.560168e-11 ] [ 3.963272e-11 2.667865e-10 2.000738e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 22.2085955 -77.6163198 -34.5157874 ] [ -37.3750309 36.2838952 19.7742427 ] [ 0.6900122 -3.3076859 9.8420949 ] [ 20.0311184 24.5217345 -18.289009 ] [ -5.5546952 20.118376 23.1884588 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.558209278405755e-08 -1.243550540006315e-07 -5.530038807639161e-08 ] [ -5.988140120300798e-08 5.813320907994476e-08 3.168182960898506e-08 ] [ 1.105521424014935e-09 -5.29949706159126e-09 1.576877447839056e-08 ] [ 3.209338985336747e-08 3.928815004105167e-08 -2.930222287881571e-08 ] [ -8.899602858431957e-09 3.223319194122639e-08 3.715200686783168e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 30.311601 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.856453886133103e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0582557 -1.029006 -0.5071668 ] [ 0.2996067 0.8167435 0.6266378 ] [ 0.2577408 1.1202962 2.9869597 ] [ 1.0413932 3.0614956 0.3511835 ] [ 0.9994516 3.3650715 2.7115053 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0582557e-10 -1.029006e-10 -5.071668e-11 ] [ 2.996067e-11 8.167435e-11 6.266378e-11 ] [ 2.577408e-11 1.1202962e-10 2.9869597e-10 ] [ 1.0413932e-10 3.0614956e-10 3.511835e-11 ] [ 9.994516e-11 3.3650715e-10 2.7115053e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.47e-05 1.5e-05 1.51e-05 ] [ 5.75e-05 -1.42e-05 -3.43e-05 ] [ -3.61e-05 4.1e-06 4.31e-05 ] [ -3.2e-05 2.54e-05 4.9e-06 ] [ 2.54e-05 -3.02e-05 -2.89e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.35519965198e-14 2.403264951e-14 2.41928671734e-14 ] [ 9.212515645499998e-14 -2.27509082028e-14 -5.49546585462e-14 ] [ -5.783857648740001e-14 6.568924199399999e-15 6.90538129254e-14 ] [ -5.126965228799999e-14 4.06952865036e-14 7.850665506599998e-15 ] [ 4.06952865036e-14 -4.838573434679999e-14 -4.63029047226e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.303887 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.811082362477636e-18 } }