{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.602926 0.6959513 1.72871 ] [ 2.385594 2.93195 2.226905 ] [ 4.246813 2.107335 1.268583 ] [ 3.789163 4.485736 1.796035 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.602926e-10 6.959513e-11 1.72871e-10 ] [ 2.385594e-10 2.93195e-10 2.226905e-10 ] [ 4.246813000000001e-10 2.107335e-10 1.268583e-10 ] [ 3.789163e-10 4.485736e-10 1.796035e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5192818 -0.7567514 0.0744521 ] [ -2.6157797 -0.5575798 1.1459624 ] [ 1.6976437 0.6869062 -0.6353561 ] [ 1.4374179 0.627425 -0.5850584 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.319811595669415e-10 -1.212449400837669e-09 1.192854139894637e-10 ] [ -4.190941080503238e-09 -8.933413197903397e-10 1.836034165595858e-09 ] [ 2.719925046588409e-09 1.100545054322569e-09 -1.017952689302667e-09 ] [ 2.302997353699433e-09 1.00524566630544e-09 -9.373668902826547e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.183813 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.631626709919911e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7206748 0.9858246 1.7466061 ] [ 1.9473566 2.9982309 2.4111124 ] [ 4.5649072 2.1122489 1.0990445 ] [ 3.7915575 4.1246679 1.76347 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7206748e-10 9.858246000000001e-11 1.7466061e-10 ] [ 1.9473566e-10 2.9982309e-10 2.4111124e-10 ] [ 4.5649072e-10 2.1122489e-10 1.0990445e-10 ] [ 3.791557500000001e-10 4.1246679e-10 1.76347e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.6e-06 -7e-06 2.03e-05 ] [ 2.19e-05 9.5e-06 -2.59e-05 ] [ 6.5e-06 -1.1e-06 -2.07e-05 ] [ -1.98e-05 -1.4e-06 2.63e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.377871893888e-14 -1.12152363456e-14 3.252418540224e-14 ] [ 3.508766799552e-14 1.52206778976e-14 -4.149637447872e-14 ] [ 1.04141480352e-14 -1.76239428288e-15 -3.316505605055999e-14 ] [ -3.172309709184e-14 -2.24304726912e-15 4.213724512704e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.837324 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.736330714483474e-18 } }