{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.4523459 0.4778673 0.765296 ] [ 0.8876723 1.989638 2.471047 ] [ 2.135329 1.164008 0.2412907 ] [ 2.495776 0.5844002 2.912252 ] [ 2.604983 2.71818 1.724062 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.523459e-11 4.778673e-11 7.65296e-11 ] [ 8.876723e-11 1.989638e-10 2.471047e-10 ] [ 2.135329e-10 1.164008e-10 2.412907e-11 ] [ 2.495776e-10 5.844002e-11 2.912252e-10 ] [ 2.604983e-10 2.71818e-10 1.724062e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.5678185 -5.5567434 6.3019858 ] [ -8.1750946 -1.6413613 1.1959265 ] [ 13.7535666 5.1688102 -2.0453459 ] [ 0.1712636 -0.1654596 -3.7734286 ] [ 6.8180829 2.1947542 -1.6791377 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.013586514105293e-08 -8.902884436613714e-09 1.009689439655979e-08 ] [ -1.309794554885958e-08 -2.629750722811864e-09 1.916085494281401e-09 ] [ 2.203564304068282e-08 8.281346928020867e-09 -3.2770054094277e-09 ] [ 2.743945381747223e-10 -2.650955049909864e-10 -6.045699132987332e-09 ] [ 1.092377311105496e-08 3.516383896613363e-09 -2.690275188208502e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.012018 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.405190446878741e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4227427 0.2607981 1.0990634 ] [ 0.6561806 2.1258464 2.4603274 ] [ 2.3692043 1.1907688 0.2432712 ] [ 2.3312206 0.5610749 2.4470181 ] [ 2.796758 2.7956052 1.8642676 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.227427e-11 2.607981e-11 1.0990634e-10 ] [ 6.561806e-11 2.1258464e-10 2.4603274e-10 ] [ 2.3692043e-10 1.1907688e-10 2.432712e-11 ] [ 2.3312206e-10 5.610749000000001e-11 2.4470181e-10 ] [ 2.796758e-10 2.7956052e-10 1.8642676e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.4e-06 -2.36e-05 8.6e-06 ] [ -3e-05 2.25e-05 -4.9e-06 ] [ -1.12e-05 -1.03e-05 -1.08e-05 ] [ 1.5e-05 2.4e-05 -2.83e-05 ] [ 2.47e-05 -1.27e-05 3.54e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.2430472876e-15 -3.78113685624e-14 1.37787190524e-14 ] [ -4.806529901999999e-14 3.6048974265e-14 -7.850665506599998e-15 ] [ -1.79443783008e-14 -1.65024193302e-14 -1.73035076472e-14 ] [ 2.403264951e-14 3.8452239216e-14 -4.53415987422e-14 ] [ 3.95737628598e-14 -2.03476432518e-14 5.671705284359999e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.467452 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.279247335191657e-18 } }