{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.000595 3.042383 1.797674 ] [ 1.826337 5.433854 1.209578 ] [ 3.662908 4.706413 0.0276768 ] [ 4.382961 3.15094 1.702274 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.000595e-10 3.042383e-10 1.797674e-10 ] [ 1.826337e-10 5.433854e-10 1.209578e-10 ] [ 3.662908e-10 4.706413e-10 2.76768e-12 ] [ 4.382961e-10 3.15094e-10 1.702274e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1752036 0.4782555 0.5397469 ] [ -0.0298942 -1.1341521 0.2381703 ] [ 1.0111802 0.328564 -0.2770369 ] [ -0.8060824 0.3273326 -0.5008802 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.807071141126823e-10 7.66249787181987e-10 8.647698714539346e-10 ] [ -4.78957887321228e-11 -1.817111994022031e-09 3.815908895727702e-10 ] [ 1.620089289203447e-09 5.26417563573576e-10 -4.438620479357945e-10 ] [ -1.291486386358641e-09 5.244446432664683e-10 -8.024985528732467e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -8.508829446151738 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.363264772131548e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0373718 3.2071467 2.1561851 ] [ 1.7661289 5.1272731 0.9741684 ] [ 3.8988469 4.9593497 0.2119731 ] [ 4.1704534 3.0398205 1.3948762 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0373718e-10 3.2071467e-10 2.1561851e-10 ] [ 1.7661289e-10 5.127273100000001e-10 9.741684000000001e-11 ] [ 3.8988469e-10 4.9593497e-10 2.119731e-11 ] [ 4.1704534e-10 3.0398205e-10 1.3948762e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.23e-05 -1.65e-05 3.97e-05 ] [ -4.69e-05 3.25e-05 -2.62e-05 ] [ 2.46e-05 3.58e-05 -1.07e-05 ] [ 3.46e-05 -5.18e-05 -2.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.97067725982e-14 -2.6435914461e-14 6.36064123698e-14 ] [ -7.514208413459999e-14 5.207074060499999e-14 -4.197702781079999e-14 ] [ 3.94135451964e-14 5.735792349719999e-14 -1.71432899838e-14 ] [ 5.54353115364e-14 -8.299274964119999e-14 -4.486094575199999e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.97474264615174 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.437912296382764e-18 } }