{ "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" [ [ -5.7950015 -11.6415241 -16.7899822 ] [ -5.7961287 -6.1720438 15.7051439 ] [ -2.0451637 10.5612957 -6.3862978 ] [ 0.6748234 -0.1518524 -0.4674691 ] [ 12.9614705 7.4041246 7.9386051 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.284615997294949e-09 -1.865177789716788e-08 -2.690051716611591e-08 ] [ -9.286421970796794e-09 -9.888704360384569e-09 2.516241459018763e-08 ] [ -3.276713492844985e-09 1.692106119530467e-08 -1.02319771129256e-08 ] [ 1.081186283556435e-09 -2.432943670968216e-10 -7.489680691370093e-10 ] [ 2.07665651773803e-08 1.18627154293446e-08 1.271904759777323e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -9.469019 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.517104098870204e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9917892 1.7323778 2.2549751 ] [ 1.6816341 2.0473654 4.7662327 ] [ 2.4313177 4.2353002 2.0450525 ] [ 4.4847632 1.3782148 2.6567998 ] [ 3.7400438 3.3747728 4.0571639 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9917892e-10 1.7323778e-10 2.2549751e-10 ] [ 1.6816341e-10 2.0473654e-10 4.7662327e-10 ] [ 2.4313177e-10 4.2353002e-10 2.0450525e-10 ] [ 4.4847632e-10 1.3782148e-10 2.6567998e-10 ] [ 3.7400438e-10 3.3747728e-10 4.0571639e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.78e-05 5.78e-05 -3.12e-05 ] [ 4.01e-05 -3.58e-05 7.8e-06 ] [ -9.8e-06 -8.7e-06 -2.6e-06 ] [ -3.1e-06 8.4e-06 8.14e-05 ] [ 5e-07 -2.18e-05 -5.54e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.454051042519999e-14 9.26058094452e-14 -4.998791098079999e-14 ] [ 6.42472830234e-14 -5.735792349719999e-14 1.24969777452e-14 ] [ -1.57013310132e-14 -1.39389367158e-14 -4.165659248399999e-15 ] [ -4.9667475654e-15 1.34582837256e-14 1.304171780076e-13 ] [ 8.010883169999999e-16 -3.492745062119999e-14 -8.876058552359998e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.739293 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.521712748027976e-18 } }