{ "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" [ [ 2.875077 1.739271 0.5500127 ] [ 2.247142 4.095662 1.890424 ] [ 4.370849 2.938246 1.693427 ] [ 3.902852 1.049683 3.036341 ] [ 5.923496 0.662055 4.457524 ] [ 5.031061 2.817229 4.209838 ] [ 4.680107 5.055758 2.976326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.875077e-10 1.739271e-10 5.500127000000001e-11 ] [ 2.247142e-10 4.095662e-10 1.890424e-10 ] [ 4.370849e-10 2.938246e-10 1.693427e-10 ] [ 3.902852e-10 1.049683e-10 3.036341e-10 ] [ 5.923496e-10 6.62055e-11 4.457524e-10 ] [ 5.031061e-10 2.817229e-10 4.209838000000001e-10 ] [ 4.680106999999999e-10 5.055758e-10 2.976326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.1840172 -6.9041737 -10.4450158 ] [ -11.1291408 6.8065683 -0.4494355 ] [ 8.7122873 2.4475597 -8.7398361 ] [ -6.3132285 -12.0479125 1.7552682 ] [ 7.5427182 -7.8643852 4.9769521 ] [ 3.6939445 5.4044228 10.7949814 ] [ 3.6774365 12.1579206 2.1070856 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.90788778046508e-09 -1.106170568808223e-08 -1.673476011864661e-08 ] [ -1.783084919935141e-08 1.09053245981384e-08 -7.200750506575584e-10 ] [ 1.395862302575276e-08 3.921422929352262e-09 -1.400276106904385e-08 ] [ -1.011490710446825e-08 -1.930288373694408e-08 2.812249673273698e-09 ] [ 1.208476675732266e-08 -1.260013410440553e-08 7.973956297461464e-09 ] [ 5.918351516432746e-09 8.658839859078475e-09 1.729546682105085e-08 ] [ 5.89190278477658e-09 1.947913614286271e-08 3.375923286344341e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 63.091345 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.01083477933827e-17 } "relaxed-configuration-positions" { "source-value" [ [ 1.6300788 0.7312036 -1.6135454 ] [ 0.6906024 4.7788659 2.0621692 ] [ 6.2270693 2.927095 0.4722734 ] [ 2.4339373 -0.5023513 3.6857144 ] [ 7.8063854 -0.8984601 4.8655463 ] [ 4.9624153 3.5450012 6.4203728 ] [ 5.2800954 7.7765497 2.9213621 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6300788e-10 7.312036e-11 -1.6135454e-10 ] [ 6.906024e-11 4.778865900000001e-10 2.0621692e-10 ] [ 6.2270693e-10 2.927095e-10 4.722734e-11 ] [ 2.4339373e-10 -5.023513e-11 3.685714400000001e-10 ] [ 7.8063854e-10 -8.984601e-11 4.8655463e-10 ] [ 4.9624153e-10 3.5450012e-10 6.420372800000001e-10 ] [ 5.2800954e-10 7.776549700000001e-10 2.9213621e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 0.0 -0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 -0.0 0.0 ] [ 0.0 -0.0 -0.0 ] [ -0.0 0.0 0.0 ] [ 0.0 0.0 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 0.0 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 0.0 } }