{ "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" [ [ -10.2120112 -15.5030964 3.8624989 ] [ -18.7654396 24.003485 1.0104325 ] [ -2.0713956 0.4334672 11.33991 ] [ 10.4280258 -7.4155949 -20.0973942 ] [ 20.6208206 -1.5182609 3.8845529 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.63614457307863e-08 -2.483869880672952e-08 6.188405486430702e-09 ] [ -3.00655488538583e-08 3.845782280156949e-08 1.618891341734205e-09 ] [ -3.31874163009041e-09 6.944910194454047e-10 1.816853883366294e-08 ] [ 1.670753927550915e-08 -1.188109287598957e-08 -3.219957539152712e-08 ] [ 3.303819693922585e-08 -2.43252213829581e-09 6.223739889916939e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.2330627 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.98646741619695e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.6702369 0.7422535 1.9667323 ] [ 2.3085184 3.2152379 1.6809043 ] [ 2.851302 1.934857 3.8420978 ] [ 3.5387232 1.3593138 0.3975911 ] [ 4.7197895 2.5519148 2.2729567 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6702369e-10 7.422535e-11 1.9667323e-10 ] [ 2.3085184e-10 3.2152379e-10 1.6809043e-10 ] [ 2.851302e-10 1.934857e-10 3.8420978e-10 ] [ 3.5387232e-10 1.3593138e-10 3.975911e-11 ] [ 4.7197895e-10 2.5519148e-10 2.2729567e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.2e-06 2.15e-05 6.1e-06 ] [ 1.34e-05 -2.74e-05 -2.9e-06 ] [ -6.4e-06 -6.9e-06 -4.7e-06 ] [ -2.4e-06 1.21e-05 1.15e-05 ] [ -1.38e-05 7e-07 -1e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.47400250328e-14 3.4446797631e-14 9.773277467399999e-15 ] [ 2.14691668956e-14 -4.389963977159999e-14 -4.6463122386e-15 ] [ -1.02539304576e-14 -1.10550187746e-14 -7.530230179799999e-15 ] [ -3.845223921599999e-15 1.93863372714e-14 1.8425031291e-14 ] [ -2.21100375492e-14 1.1215236438e-15 -1.602176634e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.709606 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.67717402965462e-18 } }