{ "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" [ [ 0.0755506 0.3541964 0.6731301 ] [ 0.5631114 0.1579036 2.39025 ] [ 0.1113923 2.692001 2.732528 ] [ 1.634511 1.700059 1.731597 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.555059999999999e-12 3.541964e-11 6.731301e-11 ] [ 5.631114000000001e-11 1.579036e-11 2.39025e-10 ] [ 1.113923e-11 2.692001e-10 2.732528e-10 ] [ 1.634511e-10 1.700059e-10 1.731597e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.007912 -2.2061819 -5.7776466 ] [ -0.5828727 -4.5218116 4.4973142 ] [ -1.988649 4.3695794 2.9136302 ] [ 4.5794337 2.3584142 -1.6332979 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.21702966302377e-09 -3.534693061412123e-09 -9.256810305764609e-09 ] [ -9.338650128425722e-10 -7.244740829182242e-09 7.205491667631855e-09 ] [ -3.186166934777299e-09 7.000837957409291e-09 4.668150188096828e-09 ] [ 7.337061610643641e-09 3.778596093402736e-09 -2.616831710181737e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.0702784 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.123481513427231e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.682468 0.154636 0.5526664 ] [ -0.334 0.0804764 2.7448434 ] [ 0.5098193 2.2974416 3.2110881 ] [ 1.526278 2.371606 1.0189072 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.82468e-11 1.54636e-11 5.526664e-11 ] [ -3.34e-11 8.04764e-12 2.7448434e-10 ] [ 5.098193e-11 2.2974416e-10 3.2110881e-10 ] [ 1.526278e-10 2.371606e-10 1.0189072e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6e-07 -8.5e-06 -2e-05 ] [ 2.38e-05 2.49e-05 -1.73e-05 ] [ -5.8e-06 1.61e-05 2.05e-05 ] [ -1.87e-05 -3.25e-05 1.67e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.6130597248e-16 -1.36185012768e-14 -3.2043532416e-14 ] [ 3.813180357504e-14 3.989419785791999e-14 -2.771765553984e-14 ] [ -9.292624400640001e-15 2.579504359488e-14 3.28446207264e-14 ] [ -2.996070280896e-14 -5.207074017599999e-14 2.675634956736e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.363135 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.660357261519421e-18 } }