{ "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" [ [ 0.0066411 1.299857 0.8298456 ] [ 0.9999642 1.240181 2.737035 ] [ 2.654666 1.132969 0.0147569 ] [ 2.745471 0.2375767 2.196855 ] [ 1.997397 2.884463 1.181944 ] [ 2.106064 2.994709 2.966195 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.6411e-13 1.299857e-10 8.298456e-11 ] [ 9.999642e-11 1.240181e-10 2.737035e-10 ] [ 2.654666e-10 1.132969e-10 1.47569e-12 ] [ 2.745471000000001e-10 2.375767e-11 2.196855e-10 ] [ 1.997397e-10 2.884463e-10 1.181944e-10 ] [ 2.106064e-10 2.994709e-10 2.966195e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.3480518 1.3002907 -4.1054636 ] [ -5.2722498 -0.740584 4.1656253 ] [ -2.773214 -1.163995 0.2087592 ] [ 3.6216976 2.0852016 -1.2327461 ] [ -3.5580545 -3.3276003 -22.6829602 ] [ 4.6337688 1.846687 23.6467854 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.364170319187357e-09 2.083295359783666e-09 -6.577677797465404e-09 ] [ -8.447075368577475e-09 -1.186546370538547e-09 6.674067466672987e-09 ] [ -4.443178635275251e-09 -1.864925575728096e-09 3.344691096169114e-10 ] [ 5.80259922232747e-09 3.340861253174753e-09 -1.975076980802379e-09 ] [ -5.700631735432234e-09 -5.331403404027066e-09 -3.634210852297689e-08 ] [ 7.424116037552472e-09 2.95871873733529e-09 3.788632672495477e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -16.344693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.618708499875341e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.427106 1.1421518 0.6694697 ] [ 0.6650192 1.3500919 2.9598731 ] [ 2.6788122 1.2892883 0.244628 ] [ 2.6116984 0.3046547 2.3355094 ] [ 1.5081506 3.1557072 0.89144 ] [ 2.6194168 2.5478618 2.8257113 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.27106e-11 1.1421518e-10 6.694697e-11 ] [ 6.650192e-11 1.3500919e-10 2.9598731e-10 ] [ 2.6788122e-10 1.2892883e-10 2.44628e-11 ] [ 2.6116984e-10 3.046547e-11 2.3355094e-10 ] [ 1.5081506e-10 3.1557072e-10 8.914400000000001e-11 ] [ 2.6194168e-10 2.547861800000001e-10 2.8257113e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.6e-06 1.17e-05 -7e-07 ] [ -4.6e-06 -2.7e-06 7.7e-06 ] [ 8.1e-06 1.32e-05 -7.4e-06 ] [ -1.5e-05 3.9e-05 -4.8e-06 ] [ 5.5e-06 -4.9e-05 6.8e-06 ] [ 7.5e-06 -1.22e-05 -1.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.56348259328e-15 1.874546646336e-14 -1.12152363456e-15 ] [ -7.370012455680001e-15 -4.32587687616e-15 1.233675998016e-14 ] [ 1.297763062848e-14 2.114873139456e-14 -1.185610699392e-14 ] [ -2.4032649312e-14 6.248488821120001e-14 -7.69044777984e-15 ] [ 8.8119714144e-15 -7.85066544192e-14 1.089480102144e-14 ] [ 1.2016324656e-14 -1.954655477376e-14 -2.4032649312e-15 ] ] } "relaxed-potential-energy" { "source-value" -25.861634 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.143490537048639e-18 } }