{ "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" [ [ 2.1688 2.788884 1.320769 ] [ 2.532136 2.630615 3.81334 ] [ 3.448306 1.022917 2.319133 ] [ 4.871015 2.854538 3.444822 ] [ 3.148673 5.011898 0.914954 ] [ 4.462028 3.106005 1.382629 ] [ 3.536809 5.003724 3.350012 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1688e-10 2.788884e-10 1.320769e-10 ] [ 2.532136e-10 2.630615e-10 3.813340000000001e-10 ] [ 3.448306e-10 1.022917e-10 2.319133e-10 ] [ 4.871015e-10 2.854538e-10 3.444822e-10 ] [ 3.148673e-10 5.011898e-10 9.149540000000001e-11 ] [ 4.462028e-10 3.106005e-10 1.382629e-10 ] [ 3.536809e-10 5.003724e-10 3.350012e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.488873 -0.5697324 -1.0517681 ] [ -1.9285171 2.0695095 1.6997977 ] [ 0.7550619 -3.8363276 -0.1336066 ] [ 2.2717831 0.6471065 3.0465736 ] [ -0.6961852 3.2311609 -0.4907831 ] [ 3.7934924 0.8396009 -2.2845101 ] [ 0.2932379 -2.3813179 -0.7857034 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.191967433593481e-09 -9.128119389127415e-10 -1.685118274206576e-09 ] [ -3.089825035889441e-09 3.315719764741022e-09 2.723376157466941e-09 ] [ 1.209742533403644e-09 -6.146474441089299e-09 -2.140613726681844e-10 ] [ 3.639797800336085e-09 1.036778914009521e-09 4.881149035681262e-09 ] [ -1.115411660376617e-09 5.17689049467441e-09 -7.863212151820854e-10 ] [ 6.077844884536581e-09 1.345188943865371e-09 -3.660188702357003e-09 ] [ 4.698189115832286e-10 -3.815291897505948e-09 -1.258835628734355e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -23.463641 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.759289735876439e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1267455 2.4878813 0.9422973 ] [ 2.354692 3.1743988 3.4018989 ] [ 3.5351262 1.1335654 2.3946811 ] [ 4.8293704 2.6386571 3.8042032 ] [ 2.5505644 4.8299902 1.4541964 ] [ 4.5503838 3.2309134 1.3254309 ] [ 4.2208846 4.9231748 3.2229512 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1267455e-10 2.4878813e-10 9.422973e-11 ] [ 2.354692e-10 3.1743988e-10 3.4018989e-10 ] [ 3.5351262e-10 1.1335654e-10 2.3946811e-10 ] [ 4.8293704e-10 2.6386571e-10 3.8042032e-10 ] [ 2.5505644e-10 4.829990200000001e-10 1.4541964e-10 ] [ 4.5503838e-10 3.2309134e-10 1.3254309e-10 ] [ 4.2208846e-10 4.923174800000001e-10 3.2229512e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6e-07 1.08e-05 -1.14e-05 ] [ -1.33e-05 -9.9e-06 2.78e-05 ] [ -4e-06 -6.2e-06 -6.9e-06 ] [ 2.76e-05 4.7e-06 1.19e-05 ] [ 1.33e-05 1.67e-05 -3.1e-06 ] [ 4e-06 -1.93e-05 -6e-06 ] [ -2.7e-05 3.1e-06 -1.23e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.613059803999998e-16 1.73035076472e-14 -1.82648136276e-14 ] [ -2.13089492322e-14 -1.58615486766e-14 4.454051042519999e-14 ] [ -6.408706535999999e-15 -9.9334951308e-15 -1.10550187746e-14 ] [ 4.42200750984e-14 7.530230179799999e-15 1.90659019446e-14 ] [ 2.13089492322e-14 2.67563497878e-14 -4.9667475654e-15 ] [ 6.408706535999999e-15 -3.09220090362e-14 -9.613059803999999e-15 ] [ -4.325876911799999e-14 4.9667475654e-15 -1.97067725982e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.557231 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.254937497194045e-18 } }