{ "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" [ [ 2.007741 0.810981 1.851579 ] [ 2.28758 2.972606 1.775704 ] [ 2.775609 2.277586 3.884458 ] [ 3.461309 1.568578 0.4572952 ] [ 4.556331 2.173826 2.191246 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.007741e-10 8.10981e-11 1.851579e-10 ] [ 2.28758e-10 2.972606e-10 1.775704e-10 ] [ 2.775609000000001e-10 2.277586e-10 3.884458e-10 ] [ 3.461309e-10 1.568578e-10 4.572952e-11 ] [ 4.556331e-10 2.173826e-10 2.191246e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.7768725 -5.103906 2.1064306 ] [ -1.9304751 5.592612 -0.098111 ] [ 0.6292929 -0.367424 1.3062933 ] [ 1.8171634 -1.4583525 -6.8233428 ] [ 3.2608913 1.3370705 3.5087299 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.051216819242448e-09 -8.177358867960846e-09 3.374873860657716e-09 ] [ -3.092962072256542e-09 8.96035219560553e-09 -1.571911504433088e-10 ] [ 1.008238372015432e-09 -5.886781427208191e-10 2.092912585167681e-09 ] [ 2.911416715653439e-09 -2.336538280385232e-09 -1.093220030986401e-08 ] [ 5.224523803830118e-09 2.142223095461367e-09 5.621605014481922e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.349478 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.818386830988394e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7867523 0.7434947 1.9811022 ] [ 2.0243062 3.150558 1.6414906 ] [ 2.8968734 2.0907986 3.6433339 ] [ 3.5190316 1.5735911 0.5414168 ] [ 4.8616064 2.2451346 2.3529387 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7867523e-10 7.434947e-11 1.9811022e-10 ] [ 2.0243062e-10 3.150558000000001e-10 1.6414906e-10 ] [ 2.8968734e-10 2.0907986e-10 3.6433339e-10 ] [ 3.5190316e-10 1.5735911e-10 5.414168000000001e-11 ] [ 4.861606400000001e-10 2.2451346e-10 2.3529387e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0670131 -0.0505121 0.0775219 ] [ -0.2430474 -0.0279069 -0.0786445 ] [ 0.006169 0.1269107 -0.1322579 ] [ -0.0292912 0.2138607 0.0265171 ] [ 0.1991565 -0.2623524 0.1068634 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.073668221073325e-10 -8.092930568751167e-11 1.242037757799955e-10 ] [ -3.894048620262259e-10 -4.471178273900352e-11 -1.260023792545056e-10 ] [ 9.8838275737152e-12 2.033333564693626e-10 -2.119005152961043e-10 ] [ -4.692967583517696e-11 3.426426136479226e-10 4.248507767141567e-11 ] [ 3.190838881803552e-10 -4.203348816907699e-10 1.712140410991987e-10 ] ] } "relaxed-potential-energy" { "source-value" -14.002843 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.243502767933293e-18 } }