{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.5419945 1.059703 1.497036 ] [ 0.5287309 2.297187 0.1799033 ] [ 1.173246 2.181689 2.79912 ] [ 2.288869 1.000101 0.1162968 ] [ 2.25753 0.9328521 1.885741 ] [ 2.965412 2.910996 0.3877363 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.419945000000001e-11 1.059703e-10 1.497036e-10 ] [ 5.287309e-11 2.297187e-10 1.799033e-11 ] [ 1.173246e-10 2.181689e-10 2.79912e-10 ] [ 2.288869e-10 1.000101e-10 1.162968e-11 ] [ 2.25753e-10 9.328521e-11 1.885741e-10 ] [ 2.965412e-10 2.910996e-10 3.877363e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -39.0644676 -19.1329581 3.5633309 ] [ -5.281289 14.1622617 -14.4939335 ] [ -1.7333429 18.4151249 20.4791299 ] [ 12.9077787 -6.6752324 -30.2271919 ] [ 30.4202392 -12.1676294 20.8791872 ] [ 2.7510815 5.3984332 -0.2005225 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.258817669271909e-08 -3.065437815456599e-08 5.709085460154224e-09 ] [ -8.461557763488211e-09 2.269044459339126e-08 -2.322184139712992e-08 ] [ -2.777121470209673e-09 2.950428258389194e-08 3.281118314010624e-08 ] [ 2.068054125960022e-08 -1.069490128968667e-08 -4.842930017461513e-08 ] [ 4.87385960453837e-08 -1.949469135523873e-08 3.345214559314662e-08 ] [ 4.407718461215395e-09 8.649243461990531e-09 -3.21272461444368e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 16.542063 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.650330659840071e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.3007669 1.9985257 1.7662048 ] [ -0.0944433 2.2715104 -0.4085326 ] [ 1.0008836 1.2581267 3.3868406 ] [ 3.2435242 1.2259843 0.3823978 ] [ 2.8193011 0.4804704 2.4167835 ] [ 3.0872838 3.1479106 -0.6778606 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.007669e-11 1.9985257e-10 1.7662048e-10 ] [ -9.44433e-12 2.2715104e-10 -4.085326e-11 ] [ 1.0008836e-10 1.2581267e-10 3.386840600000001e-10 ] [ 3.2435242e-10 1.2259843e-10 3.823978e-11 ] [ 2.8193011e-10 4.804704e-11 2.4167835e-10 ] [ 3.0872838e-10 3.1479106e-10 -6.778606e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0278932 0.0221857 0.2155652 ] [ -0.2022764 0.0639655 0.0664297 ] [ -0.4731026 0.0306924 -0.1244286 ] [ 0.1449296 -0.2107087 0.6882551 ] [ 0.4379874 0.1191396 -0.6504792 ] [ 0.0645688 -0.0252745 -0.1953423 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.468983291929856e-11 3.554540985608256e-11 3.453735236980762e-10 ] [ -3.240825190195891e-10 1.024840286377824e-10 1.064321122667578e-10 ] [ -7.579939249596941e-10 4.917464571624192e-11 -1.993565938788749e-10 ] [ 2.322028167818957e-10 -3.37592552939161e-10 1.102706230366366e-09 ] [ 7.017331724849779e-10 1.908826817314637e-10 -1.042182566556687e-09 ] [ 1.03450621793111e-10 -4.04942130024096e-11 -3.129728661132999e-10 ] ] } "relaxed-potential-energy" { "source-value" -12.89901 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.066649225346541e-18 } }