{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.7826629 0.079664 0.3147899 ] [ 0.4004832 1.295186 0.8087518 ] [ 0.7320587 0.6290848 2.788823 ] [ 1.344916 2.662801 0.2560168 ] [ 0.3963272 2.667865 2.000738 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.826629000000001e-11 7.9664e-12 3.147899e-11 ] [ 4.004832e-11 1.295186e-10 8.087518e-11 ] [ 7.320586999999999e-11 6.290848000000001e-11 2.788823e-10 ] [ 1.344916e-10 2.662801e-10 2.560168e-11 ] [ 3.963272e-11 2.667865e-10 2.000738e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 23.1990596 -81.3121487 -35.7922151 ] [ -38.8734659 38.9151233 11.3129099 ] [ 2.0534965 -9.0405995 17.909882 ] [ 19.9643359 24.5801987 -19.2093387 ] [ -6.3434261 26.8574262 25.7787618 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.71689909156658e-08 -1.302764236341531e-07 -5.734545023986474e-08 ] [ -6.228215823444603e-08 6.234890074680934e-08 1.812527975499687e-08 ] [ 3.290064083194627e-09 -1.448463715691617e-08 2.869479422168675e-08 ] [ 3.198639222877813e-08 3.938181969175855e-08 -3.077675336616867e-08 ] [ -1.016328899319252e-08 4.303034035250138e-08 4.130212946913213e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 33.026743 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.291467549577006e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4859579 -0.4871877 0.8820723 ] [ 0.2857131 1.2385904 -0.7031173 ] [ 1.0252586 0.4875447 2.9533732 ] [ 0.701218 3.279916 0.3884787 ] [ 1.1583004 2.8157373 2.6483125 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.859579e-11 -4.871877e-11 8.820723e-11 ] [ 2.857131e-11 1.2385904e-10 -7.031172999999999e-11 ] [ 1.0252586e-10 4.875447e-11 2.9533732e-10 ] [ 7.01218e-11 3.279916e-10 3.884787e-11 ] [ 1.1583004e-10 2.8157373e-10 2.6483125e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.1e-06 -1.8e-06 7.3e-06 ] [ -8.5e-06 2.1e-06 -3.51e-05 ] [ 1.2e-06 8.4e-06 2.8e-06 ] [ 8e-07 -1.25e-05 4.3e-06 ] [ 4.4e-06 3.9e-06 2.08e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.36457090368e-15 -2.88391791744e-15 1.169588933184e-14 ] [ -1.36185012768e-14 3.36457090368e-15 -5.623639939008e-14 ] [ 1.92261194496e-15 1.345828361472e-14 4.48609453824e-15 ] [ 1.28174129664e-15 -2.002720776e-14 6.889359469440001e-15 ] [ 7.04957713152e-15 6.24848882112e-15 3.332527371264e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.57084 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853852933101747e-18 } }