{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.809505 0.8723329 1.807311 ] [ 2.882593 3.596674 1.603465 ] [ 4.93122 1.133464 0.704126 ] [ 5.052691 3.651911 0.4456494 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.809505e-10 8.723329e-11 1.807311e-10 ] [ 2.882593e-10 3.596674e-10 1.603465e-10 ] [ 4.93122e-10 1.133464e-10 7.041260000000001e-11 ] [ 5.052691000000001e-10 3.651911e-10 4.456494e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5108604 3.8443618 -0.4861065 ] [ 0.4341721 -3.6733451 -0.0205008 ] [ -0.2658477 1.0071192 0.043806 ] [ -0.6791847 -1.1781358 0.4628013 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.184885961158934e-10 6.159346648602181e-09 -7.788284759355209e-10 ] [ 6.956203937547114e-10 -5.885347687838393e-09 -3.28459027383072e-11 ] [ -4.259349731426418e-10 1.613582849892773e-09 7.0184949629004e-11 ] [ -1.0881738565103e-09 -1.887581650438897e-09 7.414894290448242e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -8.1269327 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.302078167803053e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8925128 1.1311661 1.7572394 ] [ 2.8348293 3.5068148 1.623051 ] [ 5.0031803 1.1203766 0.6572335 ] [ 4.9454867 3.4960244 0.5230275 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8925128e-10 1.1311661e-10 1.7572394e-10 ] [ 2.8348293e-10 3.5068148e-10 1.623051e-10 ] [ 5.003180300000001e-10 1.1203766e-10 6.572335e-11 ] [ 4.9454867e-10 3.4960244e-10 5.230275e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.39e-05 4.75e-05 -2.22e-05 ] [ 5.7e-06 -6.7e-06 -1.18e-05 ] [ -1.87e-05 8.5e-06 -1e-07 ] [ -4.09e-05 -4.94e-05 3.4e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.635732057259999e-14 7.6103390115e-14 -3.55683212748e-14 ] [ 9.1324068138e-15 -1.07345834478e-14 -1.89056842812e-14 ] [ -2.99607030558e-14 1.3618501389e-14 -1.602176634e-16 ] [ -6.552902433059999e-14 -7.91475257196e-14 5.447400555599999e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.6379755 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.383956251116446e-18 } }