{ "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" [ [ 1.899847 1.906187 1.523281 ] [ 1.884769 1.70171 3.709853 ] [ 2.49478 3.91064 2.644859 ] [ 3.453021 0.2240813 2.013003 ] [ 4.505277 2.817941 2.046258 ] [ 4.372743 1.259433 3.808578 ] [ 3.775648 3.545824 4.38804 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.899847e-10 1.906187e-10 1.523281e-10 ] [ 1.884769e-10 1.70171e-10 3.709853e-10 ] [ 2.49478e-10 3.91064e-10 2.644859e-10 ] [ 3.453021e-10 2.240813e-11 2.013003e-10 ] [ 4.505277e-10 2.817941e-10 2.046258e-10 ] [ 4.372743e-10 1.259433e-10 3.808578e-10 ] [ 3.775648e-10 3.545824e-10 4.38804e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.0009708 -0.5572476 -6.0172354 ] [ -5.6425128 -2.9076179 8.9940155 ] [ -2.4837712 4.2448283 -5.6188022 ] [ 0.9521686 -6.6329196 -5.6719965 ] [ 5.7210757 2.3804781 -6.8948509 ] [ 1.2218089 -1.1452864 3.5333054 ] [ 3.2322016 4.6177651 11.6755641 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.808085255463473e-09 -8.9280907671691e-10 -9.640673879730136e-09 ] [ -9.040302090724747e-09 -4.658517421599592e-09 1.441000136121282e-08 ] [ -3.979440148056361e-09 6.800964661570209e-09 -9.002313521739606e-09 ] [ 1.525542269979867e-09 -1.062710871076609e-08 -9.087540185559427e-09 ] [ 9.166173732366997e-09 3.813946358146404e-09 -1.104676891588184e-08 ] [ 1.957553654665365e-09 -1.834951094200197e-09 5.660979306026393e-09 ] [ 5.178557837232353e-09 7.398475283566174e-09 1.870631583567179e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -10.250675 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.642339183241904e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5524574 1.9268863 1.9031924 ] [ 1.6153931 1.0759815 4.2744215 ] [ 2.9233185 3.9582735 2.1397316 ] [ 3.3654253 0.2118523 1.5531605 ] [ 5.2253903 2.9680111 1.8740949 ] [ 4.2287397 1.3926839 3.7939204 ] [ 3.4753606 3.8321277 4.5953508 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5524574e-10 1.9268863e-10 1.9031924e-10 ] [ 1.6153931e-10 1.0759815e-10 4.2744215e-10 ] [ 2.9233185e-10 3.9582735e-10 2.1397316e-10 ] [ 3.3654253e-10 2.118523e-11 1.5531605e-10 ] [ 5.225390300000001e-10 2.9680111e-10 1.8740949e-10 ] [ 4.2287397e-10 1.3926839e-10 3.7939204e-10 ] [ 3.4753606e-10 3.8321277e-10 4.595350800000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.03e-05 2.37e-05 4.8e-06 ] [ 1e-05 -6.3e-06 -6.5e-06 ] [ -1.46e-05 -8.9e-06 -1.5e-06 ] [ -4.8e-06 -9.6e-06 2.2e-06 ] [ 1.05e-05 -5.1e-06 -7e-06 ] [ -3.5e-06 6.2e-06 3.5e-06 ] [ -7.8e-06 -0.0 4.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.650241919424e-14 3.797158591296e-14 7.69044777984e-15 ] [ 1.6021766208e-14 -1.009371271104e-14 -1.04141480352e-14 ] [ -2.339177866368e-14 -1.425937192512e-14 -2.4032649312e-15 ] [ -7.69044777984e-15 -1.538089555968e-14 3.52478856576e-15 ] [ 1.68228545184e-14 -8.17110076608e-15 -1.12152363456e-14 ] [ -5.6076181728e-15 9.93349504896e-15 5.6076181728e-15 ] [ -1.249697764224e-14 0.0 7.2097947936e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.834016 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.177759673177313e-18 } }