{ "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" [ [ 0.8070865 2.620947 2.881943 ] [ 2.981493 2.883992 2.450576 ] [ 2.14387 2.287305 4.61196 ] [ 1.117537 4.809867 2.516966 ] [ 2.97789 5.94727 2.412215 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.070865000000001e-11 2.620947e-10 2.881943e-10 ] [ 2.981493e-10 2.883992e-10 2.450576e-10 ] [ 2.14387e-10 2.287305e-10 4.61196e-10 ] [ 1.117537e-10 4.809867e-10 2.516966e-10 ] [ 2.97789e-10 5.947269999999999e-10 2.412215e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.8946624 -2.6291955 -1.4204507 ] [ 7.0623003 0.4111019 -3.3620332 ] [ 1.4216735 -1.6413253 5.5411468 ] [ -4.0102947 3.4508049 -0.6931797 ] [ 2.4209833 0.408614 -0.0654832 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.104646690558882e-08 -4.212435561612566e-09 -2.275812902538994e-09 ] [ 1.131505242972883e-08 6.586578529464596e-10 -5.386570991393411e-09 ] [ 2.277772044110909e-09 -2.629693022787546e-09 8.877895855380733e-09 ] [ -6.425200410858151e-09 5.528798933722083e-09 -1.110596309353158e-09 ] [ 3.878842842607233e-09 6.546717977315711e-10 -1.049156520951706e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.4703916 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.036671014894071e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1996656 2.9517376 3.3825639 ] [ 3.9724471 3.3748713 3.121812 ] [ 2.2660201 1.9416438 3.8736048 ] [ 0.6290165 5.0098159 2.3284269 ] [ 2.9607273 5.2713125 2.1672524 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.996656e-11 2.9517376e-10 3.3825639e-10 ] [ 3.9724471e-10 3.3748713e-10 3.121812e-10 ] [ 2.2660201e-10 1.9416438e-10 3.8736048e-10 ] [ 6.290165e-11 5.0098159e-10 2.3284269e-10 ] [ 2.9607273e-10 5.2713125e-10 2.1672524e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.95e-05 4e-07 2.74e-05 ] [ 5.9e-06 4.36e-05 3.7e-06 ] [ -1.1e-06 -2.98e-05 -1.76e-05 ] [ 4.5e-06 -8.3e-06 -6.9e-06 ] [ 3.02e-05 -5.9e-06 -6.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.32859765216e-14 6.408706483200001e-16 4.389963940992e-14 ] [ 9.45284206272e-15 6.985490066688e-14 5.928053496960001e-15 ] [ -1.76239428288e-15 -4.774486329984001e-14 -2.819830852608e-14 ] [ 7.2097947936e-15 -1.329806595264e-14 -1.105501868352e-14 ] [ 4.838573394816e-14 -9.45284206272e-15 -1.04141480352e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.837104 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.736295466597816e-18 } }