{ "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" [ [ 2.10043 2.130682 2.453785 ] [ 1.948071 1.785129 4.606922 ] [ 2.343053 4.336787 1.957735 ] [ 4.413531 1.079857 2.965455 ] [ 3.524463 3.435576 3.796327 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.10043e-10 2.130682e-10 2.453785e-10 ] [ 1.948071e-10 1.785129e-10 4.606922e-10 ] [ 2.343053e-10 4.336787e-10 1.957735e-10 ] [ 4.413531e-10 1.079857e-10 2.965455e-10 ] [ 3.524463e-10 3.435576e-10 3.796327e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.6430382 -19.8838632 -37.3775643 ] [ -8.7619302 -10.7524393 35.8881486 ] [ -3.4114312 20.1779465 -11.3305711 ] [ -0.2239325 0.518127 -0.4748032 ] [ 20.0403321 9.940229 13.29479 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.224549721680942e-08 -3.185746101269247e-08 -5.988546015729257e-08 ] [ -1.403815983517895e-08 -1.722730700496332e-08 5.74991531244398e-08 ] [ -5.46571535713858e-09 3.232863440440208e-08 -1.815357626629568e-08 ] [ -3.58779419093205e-10 8.301309728445179e-10 -7.607185927884287e-10 ] [ 3.210815182822014e-08 1.592600264040918e-08 2.130060189193686e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.994285 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.603903364536689e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.0433685 1.7801505 2.3068759 ] [ 1.6202662 2.0197622 4.8488089 ] [ 2.4082296 4.3224514 1.9883617 ] [ 4.5692159 1.3186834 2.6309113 ] [ 3.6884678 3.3269836 4.0052662 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0433685e-10 1.7801505e-10 2.3068759e-10 ] [ 1.6202662e-10 2.0197622e-10 4.8488089e-10 ] [ 2.4082296e-10 4.3224514e-10 1.9883617e-10 ] [ 4.5692159e-10 1.3186834e-10 2.6309113e-10 ] [ 3.688467800000001e-10 3.3269836e-10 4.005266200000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.53e-05 4.73e-05 1.79e-05 ] [ 3.81e-05 -2.94e-05 -1.19e-05 ] [ 1e-07 2.8e-06 2.9e-06 ] [ -1.67e-05 -3.97e-05 2.33e-05 ] [ -4.69e-05 1.91e-05 -3.22e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.053506884019999e-14 7.578295478819998e-14 2.86789617486e-14 ] [ 6.10429297554e-14 -4.710399303959999e-14 -1.90659019446e-14 ] [ 1.602176634e-16 4.486094575199999e-15 4.6463122386e-15 ] [ -2.67563497878e-14 -6.36064123698e-14 3.733071557219999e-14 ] [ -7.514208413459999e-14 3.06015737094e-14 -5.159008761479998e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.289176 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.609813717431358e-18 } }