{ "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" [ [ 1.839954 1.796871 1.93364 ] [ 2.210383 3.445619 3.048606 ] [ 3.819674 1.353604 3.225037 ] [ 4.546382 3.666644 2.852587 ] [ 3.625014 3.17012 0.7912526 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.839954e-10 1.796871e-10 1.93364e-10 ] [ 2.210383e-10 3.445619e-10 3.048606e-10 ] [ 3.819674e-10 1.353604e-10 3.225037e-10 ] [ 4.546382e-10 3.666644e-10 2.852587000000001e-10 ] [ 3.625014e-10 3.17012e-10 7.912526e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2766711 -3.6967295 -2.8438669 ] [ 0.879483 3.8197077 2.5916601 ] [ -0.1361389 0.4164967 0.0404981 ] [ 0.1525092 -0.359492 0.2541488 ] [ -0.6191823 -0.1799828 -0.0424401 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.432759717230774e-10 -5.922813627118502e-09 -4.556377097386015e-09 ] [ 1.409087112600222e-09 6.119846425649881e-09 4.152297255490103e-09 ] [ -2.181185645584626e-10 6.673012808781077e-10 6.48851095413954e-11 ] [ 2.443466767100328e-10 -5.759696825099278e-10 4.071912689191392e-10 ] [ -9.92039413246378e-10 -2.883642366818951e-10 -6.799653656462339e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -12.419076 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.989755338307018e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1175097 1.5377967 1.6739971 ] [ 2.353429 3.4901816 3.0379548 ] [ 3.5757591 1.5052671 3.5800502 ] [ 4.7264867 3.4335364 2.7325838 ] [ 3.2682225 3.4660761 0.8265367 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1175097e-10 1.5377967e-10 1.6739971e-10 ] [ 2.353429e-10 3.4901816e-10 3.0379548e-10 ] [ 3.5757591e-10 1.5052671e-10 3.5800502e-10 ] [ 4.7264867e-10 3.4335364e-10 2.7325838e-10 ] [ 3.2682225e-10 3.4660761e-10 8.265367e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.52e-05 -1.39e-05 -7.6e-06 ] [ -8e-06 9.9e-06 3.26e-05 ] [ 1.01e-05 -9.6e-06 1.24e-05 ] [ -1.02e-05 3.9e-06 -3.4e-06 ] [ 2.33e-05 9.7e-06 -3.41e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.43530848368e-14 -2.22702552126e-14 -1.21765424184e-14 ] [ -1.2817413072e-14 1.58615486766e-14 5.22309582684e-14 ] [ 1.61819840034e-14 -1.53808956864e-14 1.98669902616e-14 ] [ -1.63422016668e-14 6.248488872599999e-15 -5.4474005556e-15 ] [ 3.733071557219999e-14 1.55411133498e-14 -5.46342232194e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.3401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.13731965152234e-18 } }