{ "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" [ [ 1.175063 2.090387 1.108777 ] [ 2.290473 2.943113 3.7458 ] [ 1.562387 4.346014 1.227002 ] [ 3.205072 1.346551 2.036178 ] [ 4.414518 1.768723 4.119804 ] [ 3.44377 3.554925 2.238453 ] [ 4.008705 3.851776 5.027783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.175063e-10 2.090387e-10 1.108777e-10 ] [ 2.290473e-10 2.943113e-10 3.7458e-10 ] [ 1.562387e-10 4.346014000000001e-10 1.227002e-10 ] [ 3.205072e-10 1.346551e-10 2.036178e-10 ] [ 4.414518e-10 1.768723e-10 4.119804e-10 ] [ 3.44377e-10 3.554925e-10 2.238453e-10 ] [ 4.008705e-10 3.851776e-10 5.027783000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3504489 -0.1002068 -0.077452 ] [ -4.193439 -2.0223893 3.9277106 ] [ -0.9993798 0.5020732 -0.4564399 ] [ 0.2279607 -1.3250247 0.0967666 ] [ 0.1166248 -0.4510613 0.046795 ] [ 4.7384419 3.0079778 -3.5654333 ] [ 0.4602403 0.3886311 0.0280528 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.614810343650771e-10 -1.605489922051814e-10 -1.240917836342016e-10 ] [ -6.718629926550931e-09 -3.240224854616077e-09 6.29288609658834e-09 ] [ -1.60118295085978e-09 8.044099429702426e-10 -7.3129733658029e-10 ] [ 3.652333040012025e-10 -2.122923596322534e-09 1.550371841943053e-10 ] [ 1.868535279654759e-10 -7.22679869407655e-10 7.497385497033601e-11 ] [ 7.591820831199132e-09 4.819311707045418e-09 -5.712453876281793e-09 ] [ 7.373862486099783e-10 6.226556625357869e-10 4.494554030797824e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -6.561985085572459 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.051345909014248e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.937725 2.1226137 1.6595696 ] [ 1.8056444 2.324157 3.8145419 ] [ 2.2464149 4.0277586 1.968709 ] [ 3.222896 1.6782989 1.7951464 ] [ 4.1296018 1.9847616 3.9437842 ] [ 4.5422457 3.5796312 2.2157863 ] [ 3.2154602 4.184268 4.1062595 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.377250000000001e-11 2.1226137e-10 1.6595696e-10 ] [ 1.8056444e-10 2.324157e-10 3.8145419e-10 ] [ 2.2464149e-10 4.0277586e-10 1.968709e-10 ] [ 3.222896e-10 1.6782989e-10 1.7951464e-10 ] [ 4.1296018e-10 1.9847616e-10 3.9437842e-10 ] [ 4.5422457e-10 3.5796312e-10 2.2157863e-10 ] [ 3.2154602e-10 4.184268e-10 4.1062595e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.9e-06 8e-06 1.8e-06 ] [ 2.45e-05 9.1e-06 5.7e-06 ] [ 1.14e-05 3.27e-05 -2.42e-05 ] [ 2.98e-05 -1.87e-05 1.87e-05 ] [ -1.4e-05 2.2e-05 -8.4e-06 ] [ -3.04e-05 -1.49e-05 -2.44e-05 ] [ -1.63e-05 -3.82e-05 3.08e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.850665441919999e-15 1.28174129664e-14 2.88391791744e-15 ] [ 3.92533272096e-14 1.457980724928e-14 9.13240673856e-15 ] [ 1.826481347712e-14 5.239117550016001e-14 -3.877267422336e-14 ] [ 4.774486329984001e-14 -2.996070280896e-14 2.996070280896e-14 ] [ -2.24304726912e-14 3.52478856576e-14 -1.345828361472e-14 ] [ -4.870616927232e-14 -2.387243164992e-14 -3.909310954752e-14 ] [ -2.611547891904e-14 -6.120314691456e-14 4.934703992064001e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.660528085572459 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.547787224328598e-18 } }