{ "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" [ [ -0.6437216 -1.5686875 2.5066286 ] [ -0.6804663 3.00703 -0.2005352 ] [ 0.1974091 -0.9908445 -0.2944608 ] [ 0.9447948 -0.7691537 -4.206758 ] [ 0.181984 0.3216557 2.1951253 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.031355697823969e-09 -2.5133144378412e-09 4.016061739948635e-09 ] [ -1.090227197102279e-09 4.817793164044223e-09 -3.212928090874522e-10 ] [ 3.162842447531693e-10 -1.587507892748266e-09 -4.717782095020647e-10 ] [ 1.513728140013412e-09 -1.232320075941817e-09 -6.739969316963366e-09 ] [ 2.915705101596672e-10 5.153492424870585e-10 3.516978435386586e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.937549 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.194347488385442e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.295109 0.7164353 2.0986679 ] [ 2.3266287 3.177523 1.6905766 ] [ 2.6612047 2.26429 3.8352963 ] [ 3.3742232 1.6571408 0.2288165 ] [ 4.4314044 1.9881879 2.3069249 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.295109e-10 7.164353e-11 2.0986679e-10 ] [ 2.3266287e-10 3.177523e-10 1.6905766e-10 ] [ 2.6612047e-10 2.26429e-10 3.8352963e-10 ] [ 3.3742232e-10 1.6571408e-10 2.288165e-11 ] [ 4.4314044e-10 1.9881879e-10 2.3069249e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4e-07 -2e-07 -3e-07 ] [ -1e-07 -1e-07 -4e-07 ] [ 1e-07 1e-07 7e-07 ] [ 1e-07 1e-07 1e-07 ] [ 3e-07 1e-07 -2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.408706483200001e-16 -3.2043532416e-16 -4.8065298624e-16 ] [ -1.6021766208e-16 -1.6021766208e-16 -6.408706483200001e-16 ] [ 1.6021766208e-16 1.6021766208e-16 1.12152363456e-15 ] [ 1.6021766208e-16 1.6021766208e-16 1.6021766208e-16 ] [ 4.8065298624e-16 1.6021766208e-16 -3.2043532416e-16 ] ] } "relaxed-potential-energy" { "source-value" -21.115797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.383123628295878e-18 } }