{ "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" [ [ 0.1501776 0.7389508 1.254214 ] [ 0.5251994 1.126951 2.894489 ] [ 1.795844 1.050789 0.3566565 ] [ 2.560887 2.159455 0.963327 ] [ 1.607121 2.890729 1.590789 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.501776e-11 7.389508e-11 1.254214e-10 ] [ 5.251994e-11 1.126951e-10 2.894489e-10 ] [ 1.795844e-10 1.050789e-10 3.566565e-11 ] [ 2.560887e-10 2.159455e-10 9.633270000000001e-11 ] [ 1.607121e-10 2.890729e-10 1.590789e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -25.2233488 -12.3854052 -17.0924882 ] [ -4.1666886 2.7807375 36.6345393 ] [ -16.2344348 -47.7306247 -39.7060234 ] [ 109.3117728 5.797299 -24.3977579 ] [ -63.6873006 51.5379934 44.5617302 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.041225974564374e-08 -1.984360665057475e-08 -2.738518498533987e-08 ] [ -6.675771061073882e-09 4.45523261108184e-09 5.86950023802388e-08 ] [ -2.601043188846193e-08 -7.647289099051902e-08 -6.361606239641772e-08 ] [ 1.751367667583614e-07 9.28829692158722e-09 -3.90895173073185e-08 ] [ -1.020383040631818e-07 8.25729681084247e-08 7.13957623088373e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 37.443813 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.999160178220711e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.0125366 1.0004008 1.0662509 ] [ 0.4865379 1.1939944 3.3775872 ] [ 1.9577734 0.4846963 -0.0849906 ] [ 3.0278641 2.3242464 0.7467543 ] [ 1.1545171 2.9635369 1.9538738 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.25366e-12 1.0004008e-10 1.0662509e-10 ] [ 4.865379e-11 1.1939944e-10 3.3775872e-10 ] [ 1.9577734e-10 4.846963e-11 -8.49906e-12 ] [ 3.0278641e-10 2.3242464e-10 7.467543e-11 ] [ 1.1545171e-10 2.9635369e-10 1.9538738e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.9e-06 1.4e-06 -2e-06 ] [ 3.1e-06 5.3e-06 4e-07 ] [ 5.1e-06 -2.5e-06 -2.7e-06 ] [ -2.3e-06 2.1e-06 1.6e-06 ] [ 1e-06 -6.3e-06 2.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.105501868352e-14 2.24304726912e-15 -3.2043532416e-15 ] [ 4.96674752448e-15 8.491536090240001e-15 6.408706483200001e-16 ] [ 8.17110076608e-15 -4.005441552e-15 -4.32587687616e-15 ] [ -3.68500622784e-15 3.36457090368e-15 2.56348259328e-15 ] [ 1.6021766208e-15 -1.009371271104e-14 4.16565921408e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.04812 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.25075694301929e-18 } }