{ "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" [ [ 1.570546 2.153895 2.543093 ] [ 2.524346 2.661693 4.212043 ] [ 2.241813 4.238266 2.673997 ] [ 3.729345 1.325386 1.859362 ] [ 4.629957 2.667135 3.458757 ] [ 3.970969 3.734581 1.387215 ] [ 4.050613 4.976756 3.428708 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.570546e-10 2.153895e-10 2.543093e-10 ] [ 2.524346e-10 2.661693e-10 4.212043000000001e-10 ] [ 2.241813e-10 4.238266e-10 2.673997e-10 ] [ 3.729345e-10 1.325386e-10 1.859362e-10 ] [ 4.629957e-10 2.667135e-10 3.458757e-10 ] [ 3.970969e-10 3.734581e-10 1.387215e-10 ] [ 4.050613e-10 4.976756e-10 3.428708e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.5227944 -3.4304968 -5.3945941 ] [ 2.3300704 0.0356205 6.8203192 ] [ -4.1979488 3.0093525 -1.6842885 ] [ -0.72637 0.9648992 0.0541116 ] [ 1.2954716 0.4015943 -0.0971412 ] [ 1.1648718 -1.3529581 -1.0830543 ] [ 2.6566994 0.3719883 1.3846474 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.041962206765164e-09 -5.496261770689213e-09 -8.643092545725618e-09 ] [ 3.733184319698105e-09 5.70703323212064e-11 1.092735596863336e-08 ] [ -6.725855422675415e-09 4.821514219246032e-09 -2.698527657382301e-09 ] [ -1.163773032050496e-09 1.545938939668623e-09 8.669634043408129e-11 ] [ 2.075574310430369e-09 6.434249985065415e-10 -1.55637359556457e-10 ] [ 1.866330364189213e-09 -2.167677836741988e-09 -1.735244278516909e-09 ] [ 4.256501667173387e-09 5.959909574711367e-10 2.218449692331506e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.342533085572459 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.176403484715468e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6551675 2.3349894 1.9735732 ] [ 2.7769353 2.6914461 4.0943635 ] [ 1.8660304 4.4849486 2.7391078 ] [ 3.6419046 1.2536339 2.3428764 ] [ 5.0806381 2.7352884 3.3366515 ] [ 3.7138071 3.5250405 1.4951129 ] [ 3.9831061 4.7323651 3.5814896 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6551675e-10 2.3349894e-10 1.9735732e-10 ] [ 2.7769353e-10 2.6914461e-10 4.0943635e-10 ] [ 1.8660304e-10 4.4849486e-10 2.739107800000001e-10 ] [ 3.6419046e-10 1.2536339e-10 2.3428764e-10 ] [ 5.0806381e-10 2.7352884e-10 3.3366515e-10 ] [ 3.7138071e-10 3.5250405e-10 1.4951129e-10 ] [ 3.9831061e-10 4.7323651e-10 3.5814896e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.21e-05 -1.79e-05 -3.7e-06 ] [ -1.24e-05 8.7e-06 2.04e-05 ] [ 9.5e-06 1.81e-05 -3.7e-05 ] [ 2.5e-06 8.9e-06 5.7e-06 ] [ 3.42e-05 1.2e-06 -3.21e-05 ] [ -1.27e-05 4.1e-06 1.87e-05 ] [ -9.1e-06 -2.31e-05 2.8e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.938633711168e-14 -2.867896151232001e-14 -5.928053496960001e-15 ] [ -1.986699009792e-14 1.393893660096e-14 3.268440306432e-14 ] [ 1.52206778976e-14 2.899939683648e-14 -5.92805349696e-14 ] [ 4.005441552e-15 1.425937192512e-14 9.13240673856e-15 ] [ 5.479444043136e-14 1.92261194496e-15 -5.142986952768e-14 ] [ -2.034764308416e-14 6.568924145279999e-15 2.996070280896e-14 ] [ -1.457980724928e-14 -3.701027994048e-14 4.48609453824e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.821491085572458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.573576339869981e-18 } }