{ "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" [ [ 0.8403174 0.0019487 1.613535 ] [ 0.0637823 2.769237 1.974876 ] [ 2.710551 0.627508 0.2521163 ] [ 2.357874 0.9595638 1.99039 ] [ 1.619464 1.82467 0.5389468 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.403174e-11 1.9487e-13 1.613535e-10 ] [ 6.37823e-12 2.769237e-10 1.974876e-10 ] [ 2.710551e-10 6.27508e-11 2.521163e-11 ] [ 2.357874e-10 9.595638e-11 1.99039e-10 ] [ 1.619464e-10 1.82467e-10 5.389467999999999e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 201.9367277 190.4597872 -26.2555669 ] [ 42.8881506 -44.9620479 -5.7456012 ] [ -302.5995298 288.0474472 164.1682919 ] [ -159.1587444 -85.9267047 -100.417223 ] [ 216.9333959 -347.6184819 -31.7499008 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.235383066673605e-07 3.051502207684523e-07 -4.206605579960381e-08 ] [ 6.871439276679307e-08 -7.203714256216876e-08 -9.20546799092236e-09 ] [ -4.848178961049467e-07 4.615028893871887e-07 2.630266013258715e-07 ] [ -2.550004213744583e-07 -1.37669758506958e-07 -1.608861283417674e-07 ] [ 3.475656180452514e-07 -5.569462092467318e-07 -5.08689491935779e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 70.86228937402345 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.135339042668068e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.8693631 0.0293436 1.6097585 ] [ 0.0699512 2.7627698 1.9740496 ] [ 2.6670263 0.6689395 0.2757296 ] [ 2.3349813 0.9472045 1.9759464 ] [ 1.6506668 1.77467 0.53438 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.693631000000001e-11 2.93436e-12 1.6097585e-10 ] [ 6.995120000000001e-12 2.7627698e-10 1.9740496e-10 ] [ 2.6670263e-10 6.689395000000001e-11 2.757296e-11 ] [ 2.3349813e-10 9.472045e-11 1.9759464e-10 ] [ 1.6506668e-10 1.77467e-10 5.3438e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2010625.2914979 -2151400.729699 1102439.3775937 ] [ -708052.7989377 696609.1793123 318476.0595882 ] [ -33136708.4220064 37215244.0871143 8466657.4248041 ] [ -795675.2013708 2490678.3865287 -4381242.563098 ] [ 36651061.7138127 -38251130.9232563 -5506330.298888 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -0.003221376861767374 -0.003446923979494287 0.001766302611182129 ] [ -0.001134425650096283 0.001116090950124083 0.0005102549011606057 ] [ -0.05309085996140966 0.05962539450498118 0.01356508069410374 ] [ -0.00127481221588954 0.003990506713705103 -0.007019524462481885 ] [ 0.0587214746891627 -0.06128506818931609 -0.008822113743964589 ] ] } "relaxed-potential-energy" { "source-value" -3560.9569916259766 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.705282086662073e-16 } }