{ "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" [ [ 2.990348 2.100415 1.411886 ] [ 2.946969 3.752547 2.888488 ] [ 5.496135 2.06422 2.457996 ] [ 4.937229 4.674633 2.559339 ] [ 4.468449 3.37128 4.359326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.990348e-10 2.100415e-10 1.411886e-10 ] [ 2.946969e-10 3.752547e-10 2.888488e-10 ] [ 5.496135e-10 2.06422e-10 2.457996e-10 ] [ 4.937229e-10 4.674633e-10 2.559339e-10 ] [ 4.468449e-10 3.37128e-10 4.359326000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.3375999 -0.7752821 -0.1542278 ] [ -3.2406463 0.7911546 -0.5611677 ] [ -1.4978406 1.0667937 0.0836559 ] [ 1.7158918 0.4696692 -1.2467788 ] [ 1.6849952 -1.5523354 1.8785184 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.143071287764418e-09 -1.242138855144728e-09 -2.471001754374182e-10 ] [ -5.192087738142023e-09 1.267569403558376e-09 -8.990897692881083e-10 ] [ -2.399805191005044e-09 1.709191925356729e-09 1.340315271719827e-10 ] [ 2.749161725782429e-09 7.524930117498394e-10 -1.997559844669079e-09 ] [ 2.69965991560022e-09 -2.487115485520216e-09 3.009718262222623e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.988117 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.401361064721504e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.4477165 2.4797888 1.3395773 ] [ 2.6059059 3.8044499 3.1368021 ] [ 5.4098942 2.0023589 2.6105215 ] [ 4.8075525 4.3495193 2.1823679 ] [ 4.5680609 3.3269781 4.4077661 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.4477165e-10 2.4797888e-10 1.3395773e-10 ] [ 2.6059059e-10 3.8044499e-10 3.1368021e-10 ] [ 5.4098942e-10 2.0023589e-10 2.6105215e-10 ] [ 4.8075525e-10 4.3495193e-10 2.1823679e-10 ] [ 4.5680609e-10 3.3269781e-10 4.4077661e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.2e-06 1.13e-05 1.6e-06 ] [ -1.9e-06 -1.76e-05 -3e-06 ] [ -8.2e-06 -6.7e-06 1.29e-05 ] [ 5.9e-06 1.06e-05 -4.1e-06 ] [ 7.4e-06 2.3e-06 -7.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.126965186560001e-15 1.810459581504e-14 2.56348259328e-15 ] [ -3.04413557952e-15 -2.819830852608e-14 -4.8065298624e-15 ] [ -1.313784829056e-14 -1.073458335936e-14 2.066807840832e-14 ] [ 9.45284206272e-15 1.698307218048e-14 -6.568924145279999e-15 ] [ 1.185610699392e-14 3.68500622784e-15 -1.169588933184e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.28693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.609453847060615e-18 } }