{ "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" [ [ 2.290406 1.365127 2.478138 ] [ 1.892594 2.812526 4.141756 ] [ 2.634032 3.625436 1.937955 ] [ 4.696761 2.293416 2.137678 ] [ 4.185297 2.165547 4.431715 ] [ 4.453239 5.273552 2.545611 ] [ 3.870361 4.380343 4.592008 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.290406e-10 1.365127e-10 2.478138e-10 ] [ 1.892594e-10 2.812526e-10 4.141756e-10 ] [ 2.634032e-10 3.625436e-10 1.937955e-10 ] [ 4.696761000000001e-10 2.293416e-10 2.137678e-10 ] [ 4.185297000000001e-10 2.165547e-10 4.431715e-10 ] [ 4.453239e-10 5.273551999999999e-10 2.545611e-10 ] [ 3.870361e-10 4.380343e-10 4.592008e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.270681 -5.5112686 -3.8938838 ] [ -2.6652897 2.6478481 3.586468 ] [ 0.5432426 3.603988 -1.9054491 ] [ 0.9203202 -0.8998974 -1.3346464 ] [ 3.4362368 -2.6833076 2.9763495 ] [ -0.607266 0.1716948 -0.6376769 ] [ -0.3565629 2.6709427 1.2088387 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.035855407467754e-09 -8.830025774617892e-09 -6.238689639871128e-09 ] [ -4.27026488018087e-09 4.242320356201295e-09 5.746155228188712e-09 ] [ 8.703706003134083e-10 5.774225362816391e-09 -3.052866025296329e-09 ] [ 1.474515520238207e-09 -1.441794587277351e-09 -2.138339276732218e-09 ] [ 5.50545830985093e-09 -4.299132738554618e-09 4.768637623517583e-09 ] [ -9.729473958226438e-10 2.750853967393031e-10 -1.021671029221554e-09 ] [ -5.712767469312786e-10 4.279321984692871e-09 1.936773119414936e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.684191 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.352666770939309e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9393904 1.3171384 2.0918959 ] [ 2.1887445 2.8882286 4.0711796 ] [ 3.0121492 3.6692678 1.6493992 ] [ 4.4424159 1.6189492 2.270186 ] [ 4.6146527 2.2163553 4.6032302 ] [ 3.9118832 5.5999147 2.7181336 ] [ 3.9134541 4.606093 4.8608365 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9393904e-10 1.3171384e-10 2.0918959e-10 ] [ 2.1887445e-10 2.8882286e-10 4.0711796e-10 ] [ 3.0121492e-10 3.6692678e-10 1.6493992e-10 ] [ 4.442415900000001e-10 1.6189492e-10 2.270186e-10 ] [ 4.6146527e-10 2.2163553e-10 4.6032302e-10 ] [ 3.9118832e-10 5.599914700000001e-10 2.7181336e-10 ] [ 3.9134541e-10 4.606093000000001e-10 4.8608365e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.2e-06 3.2e-06 7.3e-06 ] [ -6.6e-06 3.4e-06 -8.1e-06 ] [ 5.9e-06 3.2e-06 -0.0 ] [ -8e-07 -3.6e-06 -1.13e-05 ] [ 1.36e-05 -3e-07 1e-05 ] [ -3.3e-06 -6.6e-06 1.6e-06 ] [ -5.7e-06 7e-07 5e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.1269652288e-15 5.1269652288e-15 1.16958894282e-14 ] [ -1.05743657844e-14 5.4474005556e-15 -1.29776307354e-14 ] [ 9.452842140600001e-15 5.1269652288e-15 0.0 ] [ -1.2817413072e-15 -5.767835882399999e-15 -1.81045959642e-14 ] [ 2.17896022224e-14 -4.806529901999999e-16 1.602176634e-14 ] [ -5.2871828922e-15 -1.05743657844e-14 2.5634826144e-15 ] [ -9.1324068138e-15 1.1215236438e-15 8.010883169999999e-16 ] ] } "relaxed-potential-energy" { "source-value" -17.187114 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.753679245669427e-18 } }