{ "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" [ [ 0.1515051 0.6129927 0.4125648 ] [ 0.5354239 0.8367141 2.920626 ] [ 0.0380374 2.448484 2.393252 ] [ 2.476891 0.0370714 1.494005 ] [ 2.980221 0.9767319 2.515602 ] [ 2.390623 2.921281 2.114549 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.515051e-11 6.129927e-11 4.125648000000001e-11 ] [ 5.354239e-11 8.367141000000001e-11 2.920626e-10 ] [ 3.80374e-12 2.448484e-10 2.393252e-10 ] [ 2.476891e-10 3.707139999999999e-12 1.494005e-10 ] [ 2.980221e-10 9.767319e-11 2.515602e-10 ] [ 2.390623e-10 2.921281e-10 2.114549e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 0.0 ] [ 6.0172964 -17.8242991 6.863409 ] [ -5.1675228 18.6026061 -5.9474367 ] [ -17.067533 -36.907886 -39.7343263 ] [ 18.0626827 30.330616 39.712457 ] [ -1.8449234 5.7989631 -0.8941029 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 9.640771691932317e-09 -2.855767553544723e-08 1.099639352938531e-08 ] [ -8.279284285822256e-09 2.980466082492586e-08 -9.528844112934066e-09 ] [ -2.734520257262392e-08 -5.913295255953571e-08 -6.366140916559166e-08 ] [ 2.893960816929603e-08 4.859500425002654e-08 6.362637068412974e-08 ] [ -2.955893162999836e-09 9.290963180248204e-09 -1.432510774771638e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 9.1172047 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.460737233773498e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6855429 -0.8480883 0.2483439 ] [ -1.243916 1.3257119 2.9838191 ] [ 0.1657968 3.1246936 3.1940495 ] [ 2.8689411 -0.4055665 0.8003873 ] [ 3.6698768 1.4852511 1.8256472 ] [ 2.4264598 3.1512733 2.7983517 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.855428999999999e-11 -8.480883e-11 2.483439e-11 ] [ -1.243916e-10 1.3257119e-10 2.9838191e-10 ] [ 1.657968e-11 3.1246936e-10 3.1940495e-10 ] [ 2.8689411e-10 -4.055665e-11 8.003873e-11 ] [ 3.6698768e-10 1.4852511e-10 1.8256472e-10 ] [ 2.4264598e-10 3.1512733e-10 2.7983517e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.89e-05 -4.8e-06 -6.8e-06 ] [ 3.74e-05 -1.22e-05 -9.8e-06 ] [ 1.52e-05 -3.74e-05 -2.92e-05 ] [ -2.01e-05 -2.5e-06 4.7e-06 ] [ -1.01e-05 -1e-06 1.68e-05 ] [ 6.5e-06 5.79e-05 2.43e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.63029047226e-14 -7.690447843199998e-15 -1.08948011112e-14 ] [ 5.99214061116e-14 -1.95465549348e-14 -1.57013310132e-14 ] [ 2.43530848368e-14 -5.99214061116e-14 -4.67835577128e-14 ] [ -3.22037503434e-14 -4.005441585e-15 7.530230179799999e-15 ] [ -1.61819840034e-14 -1.602176634e-15 2.691656745119999e-14 ] [ 1.0414148121e-14 9.276602710859999e-14 3.893289220619999e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.329627 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.135641691933552e-18 } }