{ "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" [ [ 2.700129 2.133533 1.415237 ] [ 2.985807 2.812498 3.555959 ] [ 1.950344 4.41901 2.566342 ] [ 5.113997 2.527784 1.58139 ] [ 5.483026 3.06067 3.469124 ] [ 3.944653 4.730231 1.719663 ] [ 3.598129 4.831394 3.870985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.700129e-10 2.133533e-10 1.415237e-10 ] [ 2.985807e-10 2.812498e-10 3.555959e-10 ] [ 1.950344e-10 4.41901e-10 2.566342e-10 ] [ 5.113997e-10 2.527784e-10 1.58139e-10 ] [ 5.483026e-10 3.06067e-10 3.469124e-10 ] [ 3.944653e-10 4.730231e-10 1.719663e-10 ] [ 3.598129e-10 4.831394000000001e-10 3.870985e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.858172 -17.8429329 -10.9267168 ] [ -19.2568719 -32.6874726 32.1669839 ] [ -27.7056522 11.784837 -6.2572882 ] [ 12.7008395 -7.236201 -16.0684482 ] [ 18.6911852 -8.1345653 13.2240739 ] [ 14.2230384 34.6197529 -33.4333376 ] [ 7.2056331 19.4965819 21.2947331 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.385826219025177e-09 -2.858752993888315e-08 -1.750653019906259e-08 ] [ -3.085290994792047e-08 -5.237110439276059e-08 5.153718956623e-08 ] [ -4.438934821885608e-08 1.888139032133881e-08 -1.002528086364771e-08 ] [ 2.034898811143316e-08 -1.159367206560958e-08 -2.574449203857584e-08 ] [ 2.994657994248297e-08 -1.303301034403094e-08 2.118730203431148e-08 ] [ 2.278781960122064e-08 5.5466958714253e-08 -5.356611185803358e-08 ] [ 1.154469689088263e-08 3.123696770569244e-08 3.411792351899591e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 23.441121 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.755681603154391e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5277281 2.0733008 1.7177236 ] [ 3.0304759 1.7168259 4.0576359 ] [ 1.6988632 4.3399296 1.5433919 ] [ 4.875912 2.9445646 1.383045 ] [ 5.1321851 2.90506 3.8965817 ] [ 3.9291765 5.274834 1.6251543 ] [ 4.5817442 5.2606052 3.9551676 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5277281e-10 2.0733008e-10 1.7177236e-10 ] [ 3.0304759e-10 1.7168259e-10 4.0576359e-10 ] [ 1.6988632e-10 4.3399296e-10 1.5433919e-10 ] [ 4.875911999999999e-10 2.9445646e-10 1.383045e-10 ] [ 5.1321851e-10 2.90506e-10 3.8965817e-10 ] [ 3.9291765e-10 5.274834000000001e-10 1.6251543e-10 ] [ 4.5817442e-10 5.2606052e-10 3.9551676e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.6e-06 -7.6e-06 5.7e-06 ] [ 9.2e-06 -6.1e-06 -8.5e-06 ] [ 3.6e-06 1.43e-05 -9.6e-06 ] [ 6e-06 -1.28e-05 1.35e-05 ] [ 1.8e-06 -1.28e-05 -6e-06 ] [ -1.91e-05 5.1e-06 -1.28e-05 ] [ 6e-06 1.99e-05 1.78e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.217654231808e-14 -1.217654231808e-14 9.13240673856e-15 ] [ 1.474002491136e-14 -9.77327738688e-15 -1.36185012768e-14 ] [ 5.76783583488e-15 2.291112567744e-14 -1.538089555968e-14 ] [ 9.6130597248e-15 -2.050786074624e-14 2.16293843808e-14 ] [ 2.88391791744e-15 -2.050786074624e-14 -9.6130597248e-15 ] [ -3.060157345728e-14 8.17110076608e-15 -2.050786074624e-14 ] [ 9.6130597248e-15 3.188331475392e-14 2.851874385024e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.350653 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.619663397141338e-18 } }