{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 8.933804e-11 4.158238200000001e-10 -1.7753734e-10 ] [ -1.0533299e-10 3.8159522e-10 5.3038696e-10 ] [ 1.3101691e-10 -3.0155716e-10 -2.309853e-11 ] [ 5.681353800000001e-10 1.2460281e-10 3.867594400000001e-10 ] ] "source-value" [ [ 0.8933804 4.1582382 -1.7753734 ] [ -1.0533299 3.8159522 5.3038696 ] [ 1.3101691 -3.0155716 -0.2309853 ] [ 5.6813538 1.2460281 3.8675944 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 0.0 9.6130597248e-16 -1.6021766208e-16 ] [ 0.0 0.0 0.0 ] [ 0.0 -9.6130597248e-16 1.6021766208e-16 ] [ 0.0 0.0 0.0 ] ] "source-value" [ [ -0.0 6e-07 -1e-07 ] [ 0.0 0.0 0.0 ] [ 0.0 -6e-07 1e-07 ] [ 0.0 0.0 0.0 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 3.52339435166458e-31 "source-value" 2.1991298e-12 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -3.244864918327576e-09 6.068556055285732e-09 -7.102127563376269e-09 ] [ -5.352906536890147e-09 5.472754314873512e-09 6.868000852908115e-09 ] [ -1.157258581910323e-10 -1.031222460816183e-08 -5.060858738315144e-09 ] [ 8.713497313408756e-09 -1.229085761997408e-09 5.294985448783297e-09 ] ] "source-value" [ [ -2.0252854 3.7876948 -4.4327994 ] [ -3.3410215 3.4158246 4.286669 ] [ -0.0722304 -6.4363844 -3.1587396 ] [ 5.4385373 -0.767135 3.30487 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 3.304614570611747e-18 "source-value" 20.625782 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.364354e-10 1.928671e-10 1.025359e-10 ] [ 8.154774e-11 2.723057e-10 2.920659e-10 ] [ 1.666058e-10 9.113681e-12 6.569083000000001e-11 ] [ 2.985684e-10 1.461782e-10 2.562179e-10 ] ] "source-value" [ [ 1.364354 1.928671 1.025359 ] [ 0.8154774 2.723057 2.920659 ] [ 1.666058 0.09113681 0.6569083 ] [ 2.985684 1.461782 2.562179 ] ] } "instance-id" 1 }