{ "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" [ [ -4.1683845 3.5375094 2.1141515 ] [ 1.4667137 -2.3860116 -2.5122261 ] [ 0.6688505 -2.8772387 -2.3452054 ] [ 0.2426297 0.1042445 0.1897687 ] [ -1.2025623 -3.1658532 2.2004616 ] [ -0.0968243 -0.2816577 -1.0739596 ] [ 3.0895773 5.0690073 1.4270091 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.678488192405098e-09 5.667714856540235e-09 3.387244106129252e-09 ] [ 2.349934399547065e-09 -3.822812002477601e-09 -4.025029923583563e-09 ] [ 1.07161663391039e-09 -4.609844577600985e-09 -3.757433262853913e-09 ] [ 3.887356328517178e-10 1.670181007469856e-10 3.04042974499609e-10 ] [ -1.926717202115476e-09 -5.072255981924867e-09 3.525528130488162e-09 ] [ -1.551296297853255e-10 -4.512653820083002e-10 -1.72067296280372e-09 ] [ 4.950048518214389e-09 8.121444986724532e-09 2.286320617688849e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.988156 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.202455623610325e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8403548 4.0914822 3.4124152 ] [ 5.3337425 2.7278124 1.7758654 ] [ 3.437775 1.199683 1.8504397 ] [ 5.5105393 2.2258955 4.1533145 ] [ 3.1901718 1.8488366 4.0969375 ] [ 3.0873813 3.4460573 1.1647788 ] [ 5.1601414 4.472271 3.4676584 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8403548e-10 4.0914822e-10 3.4124152e-10 ] [ 5.3337425e-10 2.7278124e-10 1.7758654e-10 ] [ 3.437775e-10 1.199683e-10 1.8504397e-10 ] [ 5.5105393e-10 2.2258955e-10 4.153314499999999e-10 ] [ 3.1901718e-10 1.8488366e-10 4.0969375e-10 ] [ 3.0873813e-10 3.4460573e-10 1.1647788e-10 ] [ 5.1601414e-10 4.472271e-10 3.4676584e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.3e-06 -3.8e-06 -2.9e-06 ] [ -1.1e-06 2.8e-06 4.3e-06 ] [ -1.9e-06 -1.17e-05 -6e-06 ] [ -5e-07 1.01e-05 -6.2e-06 ] [ -1.17e-05 1.3e-06 -6.5e-06 ] [ 2e-06 -1.9e-06 1.75e-05 ] [ 3.9e-06 3.3e-06 -2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.490024257344e-14 -6.08827115904e-15 -4.646312200320001e-15 ] [ -1.76239428288e-15 4.48609453824e-15 6.889359469440001e-15 ] [ -3.04413557952e-15 -1.874546646336e-14 -9.6130597248e-15 ] [ -8.010883104e-16 1.618198387008e-14 -9.93349504896e-15 ] [ -1.874546646336e-14 2.08282960704e-15 -1.04141480352e-14 ] [ 3.2043532416e-15 -3.04413557952e-15 2.8038090864e-14 ] [ 6.24848882112e-15 5.28718284864e-15 -3.2043532416e-16 ] ] } "relaxed-potential-energy" { "source-value" -22.906204 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.669978452007545e-18 } }