{ "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" [ [ 2.700129 2.133533 1.415237 ] [ 2.985807 2.812498 3.555959 ] [ 1.950344 4.41901 2.566342 ] [ 5.113997 2.527784 1.58139 ] [ 5.483026 3.06067 3.469124 ] [ 3.944653 4.730231 1.719663 ] [ 3.598129 4.831394 3.870985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.700129e-10 2.133533e-10 1.415237e-10 ] [ 2.985807e-10 2.812498e-10 3.555959e-10 ] [ 1.950344e-10 4.41901e-10 2.566342e-10 ] [ 5.113997e-10 2.527784e-10 1.58139e-10 ] [ 5.483026e-10 3.06067e-10 3.469124e-10 ] [ 3.944653e-10 4.730231e-10 1.719663e-10 ] [ 3.598129e-10 4.831394000000001e-10 3.870985e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1815098 -0.9385838 -0.7577944 ] [ 0.2198349 -7.7061925 3.077218 ] [ -7.8599132 2.0401595 -3.5251943 ] [ -1.6670881 -1.3829795 -6.6858442 ] [ 1.5577401 1.2740707 6.6094232 ] [ 3.6237381 1.4958339 -5.1763203 ] [ 3.9441784 5.2176917 6.458512 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.908107580060838e-10 -1.503777021021623e-09 -1.214120471053163e-09 ] [ 3.522143372159059e-10 -1.234668145888431e-08 4.930246736704934e-09 ] [ -1.259296917055731e-08 3.268695853603018e-09 -5.647983891237421e-09 ] [ -2.670969578633892e-09 -2.215777421945674e-09 -1.071190326755128e-08 ] [ 2.495774769502654e-09 2.041286288786291e-09 1.058946332801312e-08 ] [ 5.805868463722214e-09 2.396590103180085e-09 -8.293379366432444e-09 ] [ 6.319270420744351e-09 8.359663656282206e-09 1.034767693155625e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -4.354317158928929 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.976385151584208e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.8728788 2.3431736 1.5601922 ] [ 2.8479121 2.6002087 3.9748213 ] [ 1.8652637 4.3140087 2.4881944 ] [ 5.2201837 2.576907 1.12329 ] [ 5.1619519 3.1249944 3.458148 ] [ 4.1357444 4.6246914 1.5876852 ] [ 3.6721504 4.9311363 3.9863688 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8728788e-10 2.3431736e-10 1.5601922e-10 ] [ 2.8479121e-10 2.6002087e-10 3.9748213e-10 ] [ 1.8652637e-10 4.3140087e-10 2.4881944e-10 ] [ 5.2201837e-10 2.576907e-10 1.12329e-10 ] [ 5.1619519e-10 3.1249944e-10 3.458148e-10 ] [ 4.1357444e-10 4.6246914e-10 1.5876852e-10 ] [ 3.6721504e-10 4.9311363e-10 3.9863688e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.4e-06 3.4e-05 2.6e-05 ] [ 1.38e-05 3.8e-06 -4.7e-05 ] [ 3.6e-06 -2.42e-05 2.2e-05 ] [ -1.45e-05 1.48e-05 9.8e-06 ] [ -2.13e-05 1.12e-05 6.4e-06 ] [ 2.83e-05 -4.26e-05 -4.37e-05 ] [ -8.5e-06 3e-06 2.66e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.24304726912e-15 5.44740051072e-14 4.16565921408e-14 ] [ 2.211003736704e-14 6.08827115904e-15 -7.530230117759999e-14 ] [ 5.76783583488e-15 -3.877267422336e-14 3.52478856576e-14 ] [ -2.32315610016e-14 2.371221398784e-14 1.570133088384e-14 ] [ -3.412636202304e-14 1.794437815296e-14 1.025393037312e-14 ] [ 4.534159836864e-14 -6.825272404608e-14 -7.001511832895999e-14 ] [ -1.36185012768e-14 4.8065298624e-15 4.261789811328e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.103202158928926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.298276105265201e-18 } }