{ "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" [ [ 2.860772 3.213277 0.634813 ] [ 3.47304 1.055338 1.294101 ] [ 4.886118 2.711251 1.984131 ] [ 3.680898 4.652345 1.961095 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.860772e-10 3.213277e-10 6.34813e-11 ] [ 3.47304e-10 1.055338e-10 1.294101e-10 ] [ 4.886118e-10 2.711251e-10 1.984131e-10 ] [ 3.680898e-10 4.652345e-10 1.961095e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1239816 -8.6901684 -1.6031602 ] [ 0.5511904 5.0154338 -0.1469047 ] [ -5.6561693 1.0740776 -2.7662845 ] [ 3.9809974 2.6006569 4.5163494 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.800817041729377e-09 -1.392318464129494e-08 -2.568545791837052e-09 ] [ 8.831043724894004e-10 8.035610777530104e-09 -2.353672758256378e-10 ] [ -9.062182215746702e-09 1.720862019644974e-09 -4.432076352381417e-09 ] [ 6.378260961745586e-09 4.166711683902203e-09 7.235989420044108e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.700681 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.355308740803876e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.2733229 3.1889311 0.2175083 ] [ 3.1985784 1.7262483 1.8858596 ] [ 5.0816233 2.8186893 1.4509588 ] [ 3.3473035 3.8983423 2.3198134 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.2733229e-10 3.1889311e-10 2.175083e-11 ] [ 3.1985784e-10 1.7262483e-10 1.8858596e-10 ] [ 5.081623300000001e-10 2.8186893e-10 1.4509588e-10 ] [ 3.347303500000001e-10 3.8983423e-10 2.3198134e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.62e-05 -7.4e-06 2.87e-05 ] [ -8e-07 2.81e-05 9.5e-06 ] [ -4.31e-05 1.1e-05 -3.22e-05 ] [ -2.4e-06 -3.17e-05 -6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.402055988096e-14 -1.185610699392e-14 4.598246901696e-14 ] [ -1.28174129664e-15 4.502116304448e-14 1.52206778976e-14 ] [ -6.905381235648e-14 1.76239428288e-14 -5.159008718975999e-14 ] [ -3.84522388992e-15 -5.078899887936e-14 -9.6130597248e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.027265 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.048503914076612e-18 } }