{ "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" [ [ 2.072399 2.177963 4.557602 ] [ 2.377271 3.879759 3.040396 ] [ 5.261436 0.7705425 2.642102 ] [ 4.650297 3.074511 2.607434 ] [ 3.240336 1.703827 1.872622 ] [ 3.483569 0.4560924 3.818111 ] [ 3.60342 3.885532 5.130911 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.072399e-10 2.177963e-10 4.557602e-10 ] [ 2.377271e-10 3.879759e-10 3.040396e-10 ] [ 5.261436e-10 7.705425e-11 2.642102e-10 ] [ 4.650297000000001e-10 3.074511e-10 2.607434e-10 ] [ 3.240336e-10 1.703827e-10 1.872622e-10 ] [ 3.483569e-10 4.560924000000001e-11 3.818111e-10 ] [ 3.60342e-10 3.885532e-10 5.130911000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.917804 -4.949457 3.1834608 ] [ -1.5046617 2.9494899 -4.6569597 ] [ 13.5007859 -2.7615517 -2.6330171 ] [ 14.5572049 17.0494629 4.29117 ] [ -17.8811409 -7.6135329 -12.6144622 ] [ -8.4148916 -5.9389156 9.8293526 ] [ 3.6605075 1.2645046 2.6004557 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.277014025391735e-09 -7.929904356387736e-09 5.100466509014947e-09 ] [ -2.410733817814718e-09 4.725603799998996e-09 -7.461272016819648e-09 ] [ 2.163064370961666e-08 -4.424493607322978e-09 -4.218558474542441e-09 ] [ 2.332321354713031e-08 2.731625108062988e-08 6.87521230652178e-09 ] [ -2.864874613924172e-08 -1.219822451457026e-08 -2.021059658731623e-08 ] [ -1.348214269916288e-08 -9.51519180561809e-09 1.574835906306715e-08 ] [ 5.864779585081755e-09 2.025959723705516e-09 4.166389360292113e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.616072 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.861099913726165e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1299144 2.4270733 4.8568497 ] [ 2.0398912 3.4682813 2.6209586 ] [ 5.2303425 1.2979389 3.3875834 ] [ 4.560833 3.7053268 2.5110025 ] [ 3.3302777 1.5611817 1.5620459 ] [ 2.9043171 0.3600223 3.7527533 ] [ 4.493152 3.1284026 4.9779846 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1299144e-10 2.4270733e-10 4.8568497e-10 ] [ 2.0398912e-10 3.4682813e-10 2.6209586e-10 ] [ 5.2303425e-10 1.2979389e-10 3.3875834e-10 ] [ 4.560833e-10 3.7053268e-10 2.5110025e-10 ] [ 3.3302777e-10 1.5611817e-10 1.5620459e-10 ] [ 2.9043171e-10 3.600223000000001e-11 3.752753300000001e-10 ] [ 4.493152e-10 3.1284026e-10 4.9779846e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 -5e-06 -1e-06 ] [ 5.1e-06 9.5e-06 5e-06 ] [ -4.1e-06 4.3e-06 -2e-07 ] [ 6.5e-06 -1.8e-06 -8.6e-06 ] [ -8e-07 3.4e-06 3e-06 ] [ 3.8e-06 -1.02e-05 6e-06 ] [ -1.05e-05 -2e-07 -4.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 -8.010883169999999e-15 -1.602176634e-15 ] [ 8.1711008334e-15 1.5220678023e-14 8.010883169999999e-15 ] [ -6.568924199399999e-15 6.8893595262e-15 -3.204353268e-16 ] [ 1.0414148121e-14 -2.8839179412e-15 -1.37787190524e-14 ] [ -1.2817413072e-15 5.4474005556e-15 4.806529901999999e-15 ] [ 6.088271209199999e-15 -1.63422016668e-14 9.613059803999999e-15 ] [ -1.6822854657e-14 -3.204353268e-16 -6.568924199399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.881227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.505759062264992e-18 } }