{ "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" [ [ 2.70835 3.598 3.116557 ] [ 5.398567 2.472121 1.998263 ] [ 3.170959 1.761622 1.993892 ] [ 5.798068 2.225895 4.322659 ] [ 3.522139 1.857386 4.354431 ] [ 3.141461 3.938126 0.8725825 ] [ 4.820562 4.158888 3.263025 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.70835e-10 3.598e-10 3.116557e-10 ] [ 5.398567e-10 2.472121e-10 1.998263e-10 ] [ 3.170959e-10 1.761622e-10 1.993892e-10 ] [ 5.798068e-10 2.225895e-10 4.322659e-10 ] [ 3.522139e-10 1.857386e-10 4.354431e-10 ] [ 3.141461e-10 3.938126e-10 8.725825e-11 ] [ 4.820562e-10 4.158888e-10 3.263025e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.4024297 5.4960245 2.9220552 ] [ 3.7870308 -3.8859327 -3.6807516 ] [ -0.4384568 -5.6675229 -3.9994724 ] [ 2.6286206 -1.0294985 2.1025088 ] [ -3.7583998 -8.146806 5.9775002 ] [ -2.2628003 1.6337671 -4.8866079 ] [ 6.4464351 11.5999684 1.5647677 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.025782318165556e-08 8.80560196124401e-09 4.681648526127069e-09 ] [ 6.067492210009521e-09 -6.225950521942221e-09 -5.897214160492193e-09 ] [ -7.024852341907815e-10 -9.080372688228615e-09 -6.407861174814866e-09 ] [ 4.211514470273269e-09 -1.649438427848669e-09 3.368590444386263e-09 ] [ -6.021620291179396e-09 -1.305262210739316e-08 9.577011071267323e-09 ] [ -3.625405738199226e-09 2.617583451452216e-09 -7.829208932396584e-09 ] [ 1.032832760472451e-08 1.858519817249878e-08 2.507034225922988e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.559882 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.012314930040675e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9086129 4.0022945 3.119279 ] [ 5.8730552 2.3028098 2.0792156 ] [ 3.5120354 1.8323562 1.6720208 ] [ 5.6370496 2.1220638 4.5998021 ] [ 3.2717632 1.7290989 4.2028193 ] [ 2.0567294 3.6629762 0.7966799 ] [ 5.3008603 4.3604384 3.4515929 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9086129e-10 4.0022945e-10 3.119279e-10 ] [ 5.8730552e-10 2.3028098e-10 2.0792156e-10 ] [ 3.5120354e-10 1.8323562e-10 1.6720208e-10 ] [ 5.6370496e-10 2.1220638e-10 4.5998021e-10 ] [ 3.2717632e-10 1.7290989e-10 4.2028193e-10 ] [ 2.0567294e-10 3.6629762e-10 7.966799e-11 ] [ 5.300860300000001e-10 4.3604384e-10 3.4515929e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.1e-06 -1.45e-05 1.87e-05 ] [ -7.1e-06 -1.01e-05 8e-07 ] [ -9e-07 4.6e-06 -1.03e-05 ] [ 9.7e-06 6.6e-06 1.26e-05 ] [ 9.3e-06 8e-07 9.9e-06 ] [ 2.2e-06 1.54e-05 -2.08e-05 ] [ -7e-06 -2.7e-06 -1.09e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.77327738688e-15 -2.32315610016e-14 2.996070280896e-14 ] [ -1.137545400768e-14 -1.618198387008e-14 1.28174129664e-15 ] [ -1.44195895872e-15 7.370012455680001e-15 -1.650241919424e-14 ] [ 1.554111322176e-14 1.057436569728e-14 2.018742542208e-14 ] [ 1.490024257344e-14 1.28174129664e-15 1.586154854592e-14 ] [ 3.52478856576e-15 2.467351996032e-14 -3.332527371264e-14 ] [ -1.12152363456e-14 -4.32587687616e-15 -1.746372516672e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.130246 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.744567964975272e-18 } }