{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.816977 2.980856 2.674074 ] [ 1.919186 2.00454 4.634036 ] [ 0.9862405 4.087254 4.422598 ] [ 4.092598 2.125916 2.093906 ] [ 4.150721 2.426451 4.257829 ] [ 3.183229 4.446818 3.622817 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.816977e-10 2.980856e-10 2.674074e-10 ] [ 1.919186e-10 2.00454e-10 4.634036e-10 ] [ 9.862405e-11 4.087254e-10 4.422598e-10 ] [ 4.092598e-10 2.125916e-10 2.093906e-10 ] [ 4.150721e-10 2.426451e-10 4.257829e-10 ] [ 3.183229e-10 4.446818000000001e-10 3.622817e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5648999 -2.659014 -8.820721 ] [ 1.8298124 -5.4240937 4.0392849 ] [ -7.8367778 5.3559513 5.2440403 ] [ 0.4551998 -0.3960475 -1.3852272 ] [ 0.323872 -0.9259342 1.5127396 ] [ 5.7927936 4.0491381 -0.5901166 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.05069412872258e-10 -4.260210065179891e-09 -1.41323529647996e-08 ] [ 2.931682647729938e-09 -8.690356115168568e-09 6.471647831530466e-09 ] [ -1.255590217356446e-08 8.581179955003367e-09 8.401878767193018e-09 ] [ 7.293104773528358e-10 -6.34538045226288e-10 -2.219378634336246e-09 ] [ 5.189001465317377e-10 -1.483510127639151e-09 2.423676020478344e-09 ] [ 9.281078475039869e-09 6.487434398210534e-09 -9.454710200659853e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -7.601873 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.217954319489076e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2086764 4.9573988 3.0187162 ] [ 1.9876832 1.6980847 5.151173 ] [ 0.7556023 3.4091323 4.5177481 ] [ 5.4729895 1.3310242 2.9017636 ] [ 3.9422127 0.9743417 4.445005 ] [ 2.7817873 5.7018534 1.670854 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2086764e-10 4.9573988e-10 3.0187162e-10 ] [ 1.9876832e-10 1.6980847e-10 5.151173e-10 ] [ 7.556023e-11 3.4091323e-10 4.517748100000001e-10 ] [ 5.4729895e-10 1.3310242e-10 2.9017636e-10 ] [ 3.9422127e-10 9.743417e-11 4.445005e-10 ] [ 2.7817873e-10 5.7018534e-10 1.670854e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0140671 0.0543446 -0.0143313 ] [ -0.125167 -0.0066869 0.0872348 ] [ 0.0312581 0.0767117 -0.0761168 ] [ -0.1475783 -0.1547078 0.2777859 ] [ 0.3704168 -0.0302875 -0.2902484 ] [ -0.1429967 0.0606258 0.0156758 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.253797874245568e-11 8.706964758672769e-11 -2.296127380567104e-11 ] [ -2.005396410956736e-10 -1.071359484562752e-11 1.397655570801638e-10 ] [ 5.008099703062848e-11 1.229056922818233e-10 -1.219525574101094e-10 ] [ -2.364465019974087e-10 -2.478692202154023e-10 4.450620745678867e-10 ] [ 5.934731369115495e-10 -4.852592440248e-11 -4.650292007046068e-10 ] [ -2.291059695915514e-10 9.713323937729665e-11 2.511540027233664e-11 ] ] } "relaxed-potential-energy" { "source-value" -13.553911 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.171575932460395e-18 } }