{ "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" [ [ 0.5178768 0.1602588 0.5935764 ] [ 0.4933098 1.000634 2.761993 ] [ 1.438085 2.624316 0.8145388 ] [ 2.471365 1.192312 0.8679319 ] [ 2.522268 2.85035 2.866422 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.178768e-11 1.602588e-11 5.935764e-11 ] [ 4.933098e-11 1.000634e-10 2.761993e-10 ] [ 1.438085e-10 2.624316e-10 8.145388e-11 ] [ 2.471365e-10 1.192312e-10 8.679319e-11 ] [ 2.522268e-10 2.85035e-10 2.866422e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.7449453 -0.2268476 -0.936652 ] [ 3.3432107 2.8419873 -1.3422745 ] [ -11.422012 11.6490606 -0.3639517 ] [ 11.1091161 -12.0581037 2.8168707 ] [ -1.2853695 -2.2060966 -0.1739925 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.795710564234842e-09 -3.634499212045901e-10 -1.500681936225562e-09 ] [ 5.356414021948403e-09 4.553365608670516e-09 -2.15056082259601e-09 ] [ -1.830008058889705e-08 1.866385254760242e-08 -5.831149048404154e-10 ] [ 1.779876609317287e-08 -1.931921183932198e-08 4.513124379356531e-09 ] [ -2.059388961989386e-09 -3.534556395746369e-09 -2.78766715694544e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.494655 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.001864412596182e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4715057 0.3558479 0.4205839 ] [ 0.7544811 1.1081743 2.7012529 ] [ 1.0225587 2.6738211 0.8339392 ] [ 2.6887022 0.9147271 1.2074855 ] [ 2.505657 2.7753004 2.7412006 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.715057000000001e-11 3.558479e-11 4.205839e-11 ] [ 7.544811e-11 1.1081743e-10 2.7012529e-10 ] [ 1.0225587e-10 2.6738211e-10 8.339392e-11 ] [ 2.6887022e-10 9.147271000000001e-11 1.2074855e-10 ] [ 2.505657e-10 2.7753004e-10 2.7412006e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.4e-05 -1.43e-05 -1.54e-05 ] [ 1.9e-06 4e-06 -1e-06 ] [ 1.39e-05 -1.3e-05 1.01e-05 ] [ -7.5e-06 9.7e-06 -2.8e-06 ] [ 5.8e-06 1.37e-05 9.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.24304726912e-14 -2.291112567744e-14 -2.467351996032e-14 ] [ 3.04413557952e-15 6.4087064832e-15 -1.6021766208e-15 ] [ 2.227025502912e-14 -2.08282960704e-14 1.618198387008e-14 ] [ -1.2016324656e-14 1.554111322176e-14 -4.48609453824e-15 ] [ 9.292624400640001e-15 2.194981970496e-14 1.457980724928e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.096417 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.899365623764767e-18 } }