{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.024908 1.18877 2.927879 ] [ 1.938594 2.418534 4.826435 ] [ 2.412467 3.694527 2.059811 ] [ 3.090256 4.25078 4.272664 ] [ 3.913894 1.726388 1.808826 ] [ 4.03064 2.069757 3.989682 ] [ 4.599294 3.851686 2.39416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.024908e-10 1.18877e-10 2.927879e-10 ] [ 1.938594e-10 2.418534e-10 4.826435e-10 ] [ 2.412467e-10 3.694527e-10 2.059811e-10 ] [ 3.090256e-10 4.25078e-10 4.272664e-10 ] [ 3.913894e-10 1.726388e-10 1.808826e-10 ] [ 4.03064e-10 2.069757e-10 3.989682e-10 ] [ 4.599294e-10 3.851686e-10 2.39416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.1293147 -1.7450529 -2.5682734 ] [ -2.732901 -0.7679064 0.0474841 ] [ -0.2939853 1.2602901 0.6790206 ] [ -1.5180118 3.4073321 0.0947633 ] [ -0.6370312 -2.6920485 -1.9797391 ] [ 9.3267911 -2.2285308 5.4488282 ] [ 0.9844529 2.7659164 -1.7220837 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.218068093065766e-09 -2.79588295843924e-09 -4.114827597302526e-09 ] [ -4.378590089160941e-09 -1.230321681042693e-09 7.607791487972927e-11 ] [ -4.710163745188743e-10 2.019207333645694e-09 1.087910930361588e-09 ] [ -2.432123016058526e-09 5.459147829921368e-09 1.518275437698566e-10 ] [ -1.020636495360169e-09 -4.313137168759709e-09 -3.171891701303633e-09 ] [ 1.494316664750552e-08 -3.570499946492721e-09 8.729985152795749e-09 ] [ 1.57726742065876e-09 4.431486591167301e-09 -2.759082243200761e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.841216 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.736954281624289e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6828235 0.6973602 3.3411732 ] [ 0.8232724 2.3148316 4.567398 ] [ 3.4430103 4.8212844 2.9385474 ] [ 1.8575984 4.2487552 4.3591475 ] [ 3.7358459 0.9037804 2.5673872 ] [ 5.5466372 2.0544442 3.0608244 ] [ 4.9208655 4.159986 1.4449793 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6828235e-10 6.973602e-11 3.3411732e-10 ] [ 8.232724e-11 2.3148316e-10 4.567398e-10 ] [ 3.4430103e-10 4.821284399999999e-10 2.9385474e-10 ] [ 1.8575984e-10 4.2487552e-10 4.3591475e-10 ] [ 3.7358459e-10 9.037804000000001e-11 2.5673872e-10 ] [ 5.546637200000001e-10 2.0544442e-10 3.0608244e-10 ] [ 4.920865499999999e-10 4.159986e-10 1.4449793e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.1133875 -0.0373867 0.0323803 ] [ -0.1151285 -0.0521569 -0.0451826 ] [ 0.0119418 -0.0913458 0.0594659 ] [ 0.1839765 0.2294433 -0.2199123 ] [ -0.0045145 -0.1137601 0.1120456 ] [ 0.0170933 -0.1262216 -0.1617682 ] [ -0.2067561 0.1914278 0.2229711 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.8166680159096e-10 -5.990009666886336e-11 5.187895963449025e-11 ] [ -1.844561910877728e-10 -8.356456579340352e-11 -7.239050538695808e-11 ] [ 1.913287277026944e-11 -1.463521051682726e-10 9.527487471483073e-11 ] [ 2.947628470766112e-10 3.676086910592006e-10 -3.523383456863559e-10 ] [ -7.233026354601601e-12 -1.822637725998701e-10 1.795168407835085e-10 ] [ 2.738648563232064e-11 -2.022292965599693e-10 -2.591812280288986e-10 ] [ -3.312597896277869e-10 3.067011457311783e-10 3.572390835340589e-10 ] ] } "relaxed-potential-energy" { "source-value" -15.777319 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.527805164070364e-18 } }