{ "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" [ [ 1.947833 2.66109 2.800328 ] [ 2.760428 0.8143556 5.686562 ] [ 2.02068 0.2574425 3.346376 ] [ 3.738236 1.129785 1.86566 ] [ 4.311233 0.7772723 4.159405 ] [ 3.473629 2.806736 4.589232 ] [ 4.175068 3.516721 2.41803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.947833e-10 2.66109e-10 2.800328e-10 ] [ 2.760428e-10 8.143556e-11 5.686562e-10 ] [ 2.02068e-10 2.574425e-11 3.346376e-10 ] [ 3.738236e-10 1.129785e-10 1.86566e-10 ] [ 4.311233e-10 7.772723e-11 4.159405e-10 ] [ 3.473629e-10 2.806736e-10 4.589232e-10 ] [ 4.175068e-10 3.516721e-10 2.41803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.1214549 3.4826375 -1.6542285 ] [ -4.8059786 -2.8102641 7.2911917 ] [ -8.2680114 -6.6922818 -1.968007 ] [ 4.2153204 -3.6438742 -8.5479228 ] [ 11.9847228 -5.9090087 0.2514113 ] [ 1.8346581 11.2336834 8.160831 ] [ 4.1607436 4.3391079 -3.5332756 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.46141817884616e-08 5.579800381221361e-09 -2.650366228161053e-09 ] [ -7.700026552985115e-09 -4.502539439293553e-09 1.168177687951101e-08 ] [ -1.324681456558788e-08 -1.072221743976534e-08 -3.153094804970746e-09 ] [ 6.753687794061305e-09 -5.838130052376304e-09 -1.369528206656328e-08 ] [ 1.920164267692871e-08 -9.467275591243802e-09 4.028053070649351e-10 ] [ 2.939446314981349e-09 1.799834490894906e-08 1.307509263449988e-08 ] [ 6.666246121063227e-09 6.952017232508584e-09 -5.660931561163093e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.610434 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.699978929134143e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3729129 2.959026 2.9304019 ] [ 3.0435831 0.9093363 5.2722021 ] [ 1.8701416 0.6174727 3.1458282 ] [ 4.0705927 0.8355665 2.0998585 ] [ 5.0450818 0.1657217 4.1841842 ] [ 3.114473 3.2667222 4.845694 ] [ 3.910322 3.2095571 2.3874241 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3729129e-10 2.959026e-10 2.9304019e-10 ] [ 3.0435831e-10 9.093363e-11 5.272202100000001e-10 ] [ 1.8701416e-10 6.174727e-11 3.1458282e-10 ] [ 4.0705927e-10 8.355665e-11 2.0998585e-10 ] [ 5.0450818e-10 1.657217e-11 4.1841842e-10 ] [ 3.114473e-10 3.2667222e-10 4.845694e-10 ] [ 3.910322e-10 3.2095571e-10 2.3874241e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.75e-05 -1.73e-05 2.7e-06 ] [ -1.19e-05 -1.8e-05 5.85e-05 ] [ -2.75e-05 2.26e-05 2.7e-06 ] [ 3.94e-05 5.7e-06 -5.41e-05 ] [ -1.29e-05 2.32e-05 5.6e-06 ] [ 8.3e-06 -1.06e-05 1.68e-05 ] [ 2.21e-05 -5.6e-06 -3.23e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.8038090864e-14 -2.771765553984e-14 4.32587687616e-15 ] [ -1.906590178752e-14 -2.88391791744e-14 9.37273323168e-14 ] [ -4.4059857072e-14 3.620919163008e-14 4.32587687616e-15 ] [ 6.312575885952001e-14 9.13240673856e-15 -8.667775518528e-14 ] [ -2.066807840832e-14 3.717049760256e-14 8.972189076479999e-15 ] [ 1.329806595264e-14 -1.698307218048e-14 2.691656722944e-14 ] [ 3.540810331968e-14 -8.972189076479999e-15 -5.175030485184e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.086282 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.057959479839587e-18 } }