{ "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" [ [ 2.625679 2.727046 1.588106 ] [ 1.116882 2.069952 3.236218 ] [ 3.070568 3.395161 4.858531 ] [ 1.593326 4.342716 3.66284 ] [ 4.916804 2.207526 1.823276 ] [ 3.525085 1.533636 3.413768 ] [ 3.625469 4.392152 2.422621 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.625679e-10 2.727046e-10 1.588106e-10 ] [ 1.116882e-10 2.069952e-10 3.236218e-10 ] [ 3.070568e-10 3.395161e-10 4.858531e-10 ] [ 1.593326e-10 4.342716e-10 3.66284e-10 ] [ 4.916804e-10 2.207526e-10 1.823276e-10 ] [ 3.525085e-10 1.533636e-10 3.413768e-10 ] [ 3.625469e-10 4.392152e-10 2.422621e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -29.9948866 -28.6216849 -78.8734658 ] [ -13.8319379 -0.0117368 3.0840178 ] [ 40.5066337 -30.9497435 30.1735495 ] [ -29.6409244 35.5699898 -21.1957289 ] [ 36.0684774 10.0637694 -34.544708 ] [ -8.9952004 -35.1750244 76.5778966 ] [ 5.8878382 49.1244302 24.7784387 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.80571060540672e-08 -4.585699439468439e-08 -1.263692229062284e-07 ] [ -2.216120752373745e-08 -1.880442656300544e-11 4.94114121729105e-09 ] [ 6.489878150144941e-08 -4.958695545545676e-08 4.834335557545153e-08 ] [ -4.748999609258027e-08 5.698940605965447e-08 -3.39593013043949e-08 ] [ 5.778807123813317e-08 1.612393604980244e-08 -5.534672352996273e-08 ] [ -1.441189978029081e-08 -5.635660172974954e-08 1.226913156025598e-07 ] [ 9.433356711093154e-09 7.870601357656147e-08 3.969943518506595e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 40.001113 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.408884805457895e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3779969 2.8406669 0.7247097 ] [ 1.0829897 1.8256272 2.893656 ] [ 3.728843 3.6239558 5.097151 ] [ 1.264595 4.3617019 3.8668141 ] [ 4.8422366 2.1028836 1.9550428 ] [ 3.4101357 1.1289253 4.0555582 ] [ 3.7670162 4.7844283 2.4124282 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3779969e-10 2.8406669e-10 7.247097e-11 ] [ 1.0829897e-10 1.8256272e-10 2.893656e-10 ] [ 3.728843e-10 3.6239558e-10 5.097151000000001e-10 ] [ 1.264595e-10 4.3617019e-10 3.8668141e-10 ] [ 4.8422366e-10 2.1028836e-10 1.9550428e-10 ] [ 3.4101357e-10 1.1289253e-10 4.0555582e-10 ] [ 3.7670162e-10 4.7844283e-10 2.4124282e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.15e-05 -1.2e-06 -1e-06 ] [ -5.9e-06 7e-07 2.22e-05 ] [ -6.1e-06 -5.6e-06 9.4e-06 ] [ 9.8e-06 1.23e-05 1.6e-06 ] [ 9e-07 2.4e-05 -1.53e-05 ] [ -1.29e-05 -2.42e-05 3.1e-06 ] [ -1.73e-05 -6e-06 -1.99e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.04685635552e-14 -1.92261194496e-15 -1.6021766208e-15 ] [ -9.45284206272e-15 1.12152363456e-15 3.556832098176e-14 ] [ -9.77327738688e-15 -8.972189076479999e-15 1.506046023552e-14 ] [ 1.570133088384e-14 1.970677243584e-14 2.56348259328e-15 ] [ 1.44195895872e-15 3.84522388992e-14 -2.451330229824e-14 ] [ -2.066807840832e-14 -3.877267422336e-14 4.96674752448e-15 ] [ -2.771765553984e-14 -9.6130597248e-15 -3.188331475392e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.619169 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.143337389132412e-18 } }