{ "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" [ [ 0.0221122 0.00357 0.1110342 ] [ 0.2725629 2.182164 0.260904 ] [ 0.3472204 2.881652 2.59775 ] [ 1.734388 0.2655593 2.566686 ] [ 2.338795 2.363947 0.0295877 ] [ 1.600298 1.908592 1.497057 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.21122e-12 3.57e-13 1.110342e-11 ] [ 2.725629e-11 2.182164e-10 2.60904e-11 ] [ 3.472204e-11 2.881652e-10 2.59775e-10 ] [ 1.734388e-10 2.655593e-11 2.566686e-10 ] [ 2.338795e-10 2.363947e-10 2.95877e-12 ] [ 1.600298e-10 1.908592e-10 1.497057e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9435777 -0.6242808 1.1459736 ] [ -6.6221386 1.3517195 -3.2949111 ] [ -2.6903639 2.179087 1.4834375 ] [ -0.7946444 -2.9540412 -0.3343828 ] [ 5.4364432 2.0179524 -7.5469589 ] [ 3.727126 -1.9704369 8.5468416 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.511778143303462e-09 -1.000208110814827e-09 1.836052125100862e-09 ] [ -1.060983573202947e-08 2.165693398622163e-09 -5.279029575527237e-09 ] [ -4.310438177537112e-09 3.491282274853158e-09 2.376728900499374e-09 ] [ -1.273160690018949e-09 -4.73289578651332e-09 -5.357403089714951e-10 ] [ 8.71014226710819e-09 3.233116183804221e-09 -1.209156120733834e-08 ] [ 5.971514189173884e-09 -3.156987959951394e-09 1.369354990601917e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -7.861962619227607 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.259625280590791e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5102895 0.1690116 0.1899053 ] [ -0.3246014 2.4498935 0.1068973 ] [ 0.2251797 2.5004231 2.3857037 ] [ 1.1977278 0.2789601 2.4223535 ] [ 2.0667882 1.9971251 -0.152716 ] [ 2.6399926 2.2100709 2.1108751 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.102895e-11 1.690116e-11 1.899053e-11 ] [ -3.246014e-11 2.4498935e-10 1.068973e-11 ] [ 2.251797e-11 2.5004231e-10 2.3857037e-10 ] [ 1.1977278e-10 2.789601e-11 2.4223535e-10 ] [ 2.0667882e-10 1.9971251e-10 -1.52716e-11 ] [ 2.6399926e-10 2.2100709e-10 2.1108751e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.95e-05 1.2e-06 5e-06 ] [ 2.55e-05 1.4e-06 1.25e-05 ] [ 2.4e-06 -8.7e-06 -1.22e-05 ] [ 2.1e-05 -2.9e-06 -1.6e-05 ] [ 2.2e-06 -1.31e-05 -5.1e-06 ] [ -2.16e-05 2.21e-05 1.58e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.726421070299999e-14 1.9226119608e-15 8.010883169999999e-15 ] [ 4.0855504167e-14 2.2430472876e-15 2.0027207925e-14 ] [ 3.845223921599999e-15 -1.39389367158e-14 -1.95465549348e-14 ] [ 3.364570931399999e-14 -4.6463122386e-15 -2.5634826144e-14 ] [ 3.5247885948e-15 -2.09885139054e-14 -8.1711008334e-15 ] [ -3.46070152944e-14 3.54081036114e-14 2.53143908172e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.509304719227607 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.64508222647324e-18 } }