{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 3.052782 0.533749 2.863364 ] [ 2.918449 2.894241 2.581593 ] [ 2.15775 1.828991 4.761683 ] [ 4.980199 1.864144 2.667187 ] [ 4.882978 3.954202 1.645371 ] [ 4.390119 4.230009 4.149708 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.052782e-10 5.33749e-11 2.863364e-10 ] [ 2.918449e-10 2.894241e-10 2.581593e-10 ] [ 2.15775e-10 1.828991e-10 4.761683e-10 ] [ 4.980199e-10 1.864144e-10 2.667187e-10 ] [ 4.882978e-10 3.954202e-10 1.645371e-10 ] [ 4.390119000000001e-10 4.230009e-10 4.149708000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3139109 -0.1394831 0.4496698 ] [ -1.3659813 0.8979678 0.645493 ] [ 0.5846625 0.1670978 -0.8967278 ] [ 1.3695069 -0.6955567 0.3959632 ] [ 0.0016887 0.5255976 0.3751489 ] [ -0.2759659 -0.7556234 -0.969547 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.029407049942867e-10 -2.234765618167085e-10 7.204504406398118e-10 ] [ -2.188543303309991e-09 1.43870301539121e-09 1.034193793490054e-09 ] [ 9.3673258855848e-10 2.677201885471142e-10 -1.436716316381418e-09 ] [ 2.194191937204284e-09 -1.114404683180799e-09 6.344029817371546e-10 ] [ 2.70559565954496e-12 8.421001866685901e-10 6.010547968988372e-10 ] [ -4.421461131180307e-10 -1.210642145609407e-09 -1.553385536166778e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.920801 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.031446500900926e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.2404559 0.815105 2.8903262 ] [ 2.2639762 2.8572746 2.0830515 ] [ 2.4990479 2.4898094 4.4463904 ] [ 5.3655617 1.8087574 2.8334493 ] [ 4.389082 3.8509269 2.026175 ] [ 4.6241533 3.4834626 4.3895136 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.2404559e-10 8.15105e-11 2.8903262e-10 ] [ 2.2639762e-10 2.8572746e-10 2.0830515e-10 ] [ 2.4990479e-10 2.4898094e-10 4.4463904e-10 ] [ 5.3655617e-10 1.8087574e-10 2.8334493e-10 ] [ 4.389082e-10 3.850926900000001e-10 2.026175e-10 ] [ 4.6241533e-10 3.4834626e-10 4.3895136e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4e-07 -0.0 -2.9e-06 ] [ 1.5e-06 -2.6e-06 1.7e-06 ] [ -9e-07 2.4e-06 1.5e-06 ] [ -1.1e-06 2.3e-06 -3e-07 ] [ 8e-07 -1.2e-06 -1.1e-06 ] [ -0.0 -9e-07 1.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.408706483200001e-16 0.0 -4.646312200320001e-15 ] [ 2.4032649312e-15 -4.16565921408e-15 2.72370025536e-15 ] [ -1.44195895872e-15 3.84522388992e-15 2.4032649312e-15 ] [ -1.76239428288e-15 3.68500622784e-15 -4.8065298624e-16 ] [ 1.28174129664e-15 -1.92261194496e-15 -1.76239428288e-15 ] [ 0.0 -1.44195895872e-15 1.76239428288e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.411418 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.27026967169763e-18 } }