{ "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" [ [ 2.146488 0.2959799 2.352543 ] [ 2.393537 2.53814 1.109639 ] [ 1.99319 1.640865 4.12466 ] [ 3.097066 3.51077 3.500726 ] [ 3.970578 1.750203 2.795194 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.146488e-10 2.959799e-11 2.352543e-10 ] [ 2.393537e-10 2.53814e-10 1.109639e-10 ] [ 1.99319e-10 1.640865e-10 4.12466e-10 ] [ 3.097066e-10 3.51077e-10 3.500726e-10 ] [ 3.970578e-10 1.750203e-10 2.795194e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.582763 -0.9476229 -2.4089518 ] [ 0.2192428 -0.2213373 0.7056088 ] [ -1.8981981 -0.4827099 3.510767 ] [ -2.0723972 6.2425522 0.4997527 ] [ 4.3341154 -4.5908821 -2.3071767 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.336892617597419e-10 -1.518259268223319e-09 -3.859566286392241e-09 ] [ 3.512656913327352e-10 -3.546214502926481e-10 1.130509932104779e-09 ] [ -3.041248642523196e-09 -7.733865227804766e-10 5.624868854818277e-09 ] [ -3.320346370207024e-09 1.00016712713653e-08 8.006920987184118e-10 ] [ 6.944018422939562e-09 -7.355404030068851e-09 -3.696504599249227e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.145921 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.945991082460991e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9679435 0.4659924 2.2183135 ] [ 2.5758239 2.5512391 1.1377563 ] [ 2.1725198 1.5309356 4.3884367 ] [ 2.7804503 3.6161698 3.30788 ] [ 4.1041215 1.571621 2.8303755 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9679435e-10 4.659924e-11 2.2183135e-10 ] [ 2.5758239e-10 2.5512391e-10 1.1377563e-10 ] [ 2.1725198e-10 1.5309356e-10 4.3884367e-10 ] [ 2.7804503e-10 3.6161698e-10 3.30788e-10 ] [ 4.1041215e-10 1.571621e-10 2.8303755e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.82e-05 -1.62e-05 6.1e-06 ] [ 1.36e-05 2.82e-05 -5.81e-05 ] [ -1.36e-05 -2.34e-05 5.53e-05 ] [ -2.33e-05 2.13e-05 8e-07 ] [ 6.15e-05 -1e-05 -4.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.12031474188e-14 -2.59552614708e-14 9.773277467399999e-15 ] [ 2.17896022224e-14 4.51813810788e-14 -9.308646243539999e-14 ] [ -2.17896022224e-14 -3.749093323559999e-14 8.86003678602e-14 ] [ -3.733071557219999e-14 3.41263623042e-14 1.2817413072e-15 ] [ 9.8533862991e-14 -1.602176634e-14 -6.568924199399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.867937 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.221888462318406e-18 } }