{ "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" [ [ 2.596447 0.5894877 3.838334 ] [ 1.369077 2.86119 3.866131 ] [ 2.011058 5.105046 2.796353 ] [ 3.116098 2.834339 2.386368 ] [ 3.638135 2.33604 4.892399 ] [ 3.921466 4.7829 1.89112 ] [ 5.122204 3.316972 3.335617 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.596447e-10 5.894877e-11 3.838334e-10 ] [ 1.369077e-10 2.86119e-10 3.866131e-10 ] [ 2.011058e-10 5.105046e-10 2.796353e-10 ] [ 3.116098e-10 2.834339e-10 2.386368e-10 ] [ 3.638135e-10 2.33604e-10 4.892399e-10 ] [ 3.921466e-10 4.7829e-10 1.89112e-10 ] [ 5.122204e-10 3.316972e-10 3.335617e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3745486 -1.4217232 0.0207985 ] [ -1.7115366 1.0379942 0.6695799 ] [ -3.0245204 1.5481092 1.3694144 ] [ -1.3395984 -4.3420541 -4.0649621 ] [ 1.2425622 0.0233918 2.5953059 ] [ 2.5970207 3.2699952 -2.0922281 ] [ 2.6106212 -0.1157131 1.5020915 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.000930102733709e-10 -2.277851672288963e-09 3.33228704477088e-11 ] [ -2.742183926163521e-09 1.663050039765999e-09 1.072785261537602e-09 ] [ -4.845815874012664e-09 2.480344366685391e-09 2.194043735866859e-09 ] [ -2.146273237741087e-09 -6.956737565268786e-09 -6.512787241058072e-09 ] [ 1.990804106729814e-09 3.747779507842944e-11 4.158138436804303e-09 ] [ 4.16088584927365e-09 5.23910985956822e-09 -3.352118947200804e-09 ] [ 4.182676252404842e-09 -1.853928235402925e-10 2.406615883602403e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.157239 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.787586747847797e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.7968881 1.0340636 3.2992281 ] [ 1.4118117 3.3456229 3.8508765 ] [ 2.2468182 5.3198368 3.0964834 ] [ 2.3856355 2.3101503 2.0284832 ] [ 3.1328953 2.5447147 5.1098383 ] [ 3.8146792 4.1255058 1.9654433 ] [ 4.985757 3.1460806 3.655969 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.7968881e-10 1.0340636e-10 3.2992281e-10 ] [ 1.4118117e-10 3.3456229e-10 3.8508765e-10 ] [ 2.2468182e-10 5.3198368e-10 3.0964834e-10 ] [ 2.3856355e-10 2.3101503e-10 2.0284832e-10 ] [ 3.1328953e-10 2.5447147e-10 5.1098383e-10 ] [ 3.8146792e-10 4.1255058e-10 1.9654433e-10 ] [ 4.985757e-10 3.1460806e-10 3.655969e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.3e-06 -8.7e-06 -1.5e-05 ] [ -9.1e-06 7.1e-06 -2.2e-06 ] [ 7.6e-06 -2.13e-05 -2.1e-06 ] [ 2.7e-06 1.06e-05 1.81e-05 ] [ 2e-06 1.02e-05 -7.4e-06 ] [ -1e-07 -4.5e-06 5.7e-06 ] [ -7.4e-06 6.6e-06 2.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.889359469440001e-15 -1.393893660096e-14 -2.4032649312e-14 ] [ -1.457980724928e-14 1.137545400768e-14 -3.52478856576e-15 ] [ 1.217654231808e-14 -3.412636202304e-14 -3.36457090368e-15 ] [ 4.32587687616e-15 1.698307218048e-14 2.899939683648e-14 ] [ 3.2043532416e-15 1.634220153216e-14 -1.185610699392e-14 ] [ -1.6021766208e-16 -7.2097947936e-15 9.13240673856e-15 ] [ -1.185610699392e-14 1.057436569728e-14 4.48609453824e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.4213 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.310546970154304e-18 } }