{ "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" [ [ -6.0191434 6.014907 3.7088002 ] [ 5.2659838 -2.848256 -5.5581899 ] [ -0.7843615 -7.0638513 -4.2005018 ] [ 1.7015838 -1.8953425 2.8095569 ] [ -2.2567492 -5.7774431 6.8880499 ] [ -1.4982373 2.5852666 -5.0341512 ] [ 3.5909238 8.9847193 1.3864359 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.643730832722622e-09 9.636943371686265e-09 5.942152971658365e-09 ] [ 8.437036129871543e-09 -4.563409173253325e-09 -8.90520191174669e-09 ] [ -1.256685657555619e-09 -1.131753740566768e-08 -6.729945779588316e-09 ] [ 2.726237782692023e-09 -3.036673441908624e-09 4.501406379987324e-09 ] [ -3.615710807249103e-09 -9.256484262822277e-09 1.103587251268378e-08 ] [ -2.400440774470516e-09 4.142053705055106e-09 -8.065599358212265e-09 ] [ 5.753294159434296e-09 1.439510720691054e-08 2.221315185217807e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.4405891 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.352331452179932e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7722957 4.1211295 3.4339819 ] [ 5.782373 1.7461111 1.8396266 ] [ 3.5166177 1.466742 1.6653009 ] [ 5.5757876 2.5195096 3.9846781 ] [ 3.3171559 1.9052431 3.9560436 ] [ 2.6461566 3.5377957 1.2235756 ] [ 4.9497196 4.715507 3.8182028 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7722957e-10 4.1211295e-10 3.4339819e-10 ] [ 5.782373e-10 1.7461111e-10 1.8396266e-10 ] [ 3.5166177e-10 1.466742e-10 1.6653009e-10 ] [ 5.5757876e-10 2.5195096e-10 3.9846781e-10 ] [ 3.3171559e-10 1.9052431e-10 3.9560436e-10 ] [ 2.6461566e-10 3.5377957e-10 1.2235756e-10 ] [ 4.9497196e-10 4.715507e-10 3.8182028e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.2e-06 -6.6e-06 5e-07 ] [ 1.94e-05 -2.48e-05 -3.01e-05 ] [ -1.28e-05 -1e-06 -3.5e-06 ] [ 1.09e-05 1.12e-05 1.83e-05 ] [ -1.16e-05 3.7e-06 2.7e-06 ] [ -2e-06 -5e-07 -4.4e-06 ] [ 2e-07 1.81e-05 1.64e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.72914180736e-15 -1.057436569728e-14 8.010883104e-16 ] [ 3.108222644352e-14 -3.973398019584e-14 -4.822551628608e-14 ] [ -2.050786074624e-14 -1.6021766208e-15 -5.6076181728e-15 ] [ 1.746372516672e-14 1.794437815296e-14 2.931983216064e-14 ] [ -1.858524880128e-14 5.928053496960001e-15 4.32587687616e-15 ] [ -3.2043532416e-15 -8.010883104e-16 -7.04957713152e-15 ] [ 3.2043532416e-16 2.899939683648e-14 2.627569658112e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.403283 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.307660328536609e-18 } }