{ "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" [ [ 2.717363 2.851349 1.457488 ] [ 0.2108152 2.748454 1.624055 ] [ 2.409053 4.258926 3.949315 ] [ 4.77033 2.580775 2.438947 ] [ 3.623649 2.286945 4.240246 ] [ 4.139768 4.74377 1.918983 ] [ 5.145543 4.155434 3.91724 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.717363e-10 2.851349e-10 1.457488e-10 ] [ 2.108152e-11 2.748454e-10 1.624055e-10 ] [ 2.409053e-10 4.258926e-10 3.949315e-10 ] [ 4.770330000000001e-10 2.580775e-10 2.438947e-10 ] [ 3.623649e-10 2.286945e-10 4.240246e-10 ] [ 4.139768e-10 4.743769999999999e-10 1.918983e-10 ] [ 5.145543e-10 4.155434e-10 3.91724e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.2217443 -1.5425778 -0.3931971 ] [ 2.2265642 0.1186824 -0.0532118 ] [ 13.7427232 1.2076833 -8.9772883 ] [ 8.5585375 -13.0548424 -6.103248 ] [ -8.1414037 -10.8690321 6.9154088 ] [ -6.1017258 11.463802 0.1592794 ] [ -0.0629512 12.6762847 8.452257 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.637703987618268e-08 -2.471482107287125e-09 -6.299712061765613e-10 ] [ 3.567349135340902e-09 1.901501681470416e-10 -8.525470261308119e-11 ] [ 2.201826999856971e-08 1.934921964532012e-09 -1.438320155094158e-08 ] [ 1.371228880371277e-08 -2.091616345383248e-08 -9.77848133710723e-09 ] [ -1.304396677610114e-08 -1.741410926481595e-08 1.107970639391798e-08 ] [ -9.776042503834955e-09 1.836703570120246e-08 2.551937329575396e-10 ] [ -1.008589417222608e-10 2.03096471522717e-08 1.354200866996294e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -16.298688 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.611337707845619e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3098439 3.5685634 1.513845 ] [ 0.5768366 2.0028405 1.7144504 ] [ 2.7411883 4.5200421 3.7596269 ] [ 4.4242416 2.4513711 2.1589143 ] [ 3.3602405 2.1694436 4.4264166 ] [ 4.4172271 4.9749592 1.9120892 ] [ 5.1869432 3.9384331 4.0609317 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3098439e-10 3.5685634e-10 1.513845e-10 ] [ 5.768366000000001e-11 2.0028405e-10 1.7144504e-10 ] [ 2.7411883e-10 4.520042100000001e-10 3.759626900000001e-10 ] [ 4.4242416e-10 2.4513711e-10 2.1589143e-10 ] [ 3.3602405e-10 2.1694436e-10 4.4264166e-10 ] [ 4.4172271e-10 4.9749592e-10 1.9120892e-10 ] [ 5.1869432e-10 3.9384331e-10 4.0609317e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.98e-05 -3.44e-05 2.4e-06 ] [ -1.52e-05 5.68e-05 5.14e-05 ] [ -1.27e-05 -9.02e-05 3.85e-05 ] [ 6.1e-06 3.12e-05 -4.56e-05 ] [ 2.33e-05 0.0001017 -7.73e-05 ] [ -2.35e-05 -8.14e-05 7.2e-06 ] [ -7.78e-05 1.62e-05 2.35e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.598972280732e-13 -5.51148762096e-14 3.845223921599999e-15 ] [ -2.43530848368e-14 9.100363281119999e-14 8.23518789876e-14 ] [ -2.03476432518e-14 -1.445163323868e-13 6.168380040899999e-14 ] [ 9.773277467399999e-15 4.998791098079999e-14 -7.30592545104e-14 ] [ 3.733071557219999e-14 1.629413636778e-13 -1.238482538082e-13 ] [ -3.765115089899999e-14 -1.304171780076e-13 1.15356717648e-14 ] [ -1.246493421252e-13 2.59552614708e-14 3.765115089899999e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.571057 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.936717339808214e-18 } }