{ "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" [ [ 2.841627 2.849258 1.50686 ] [ 0.998489 4.149663 3.105849 ] [ 4.765797 1.647113 1.498592 ] [ 3.299037 1.906995 3.475865 ] [ 3.256514 4.175642 3.223298 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.841627e-10 2.849258e-10 1.50686e-10 ] [ 9.98489e-11 4.149663e-10 3.105849e-10 ] [ 4.765797e-10 1.647113e-10 1.498592e-10 ] [ 3.299037e-10 1.906995e-10 3.475865e-10 ] [ 3.256514e-10 4.175642e-10 3.223298000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.5384823 1.270236 -10.2258553 ] [ -4.2744336 1.8204299 1.2219917 ] [ 5.6193425 -3.1393031 -3.2831426 ] [ 0.1212754 -7.1418366 9.08766 ] [ 2.072298 7.1904737 3.1993463 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.669273614174612e-09 2.035142422098509e-09 -1.638362628934377e-08 ] [ -6.84839758108198e-09 2.916650225585281e-09 1.957846532551648e-09 ] [ 9.003179177767824e-09 -5.029718032424964e-09 -5.260174316472527e-09 ] [ 1.943046105581683e-10 -1.144248363009376e-08 1.456003638977933e-08 ] [ 3.320187406930598e-09 1.152040885461727e-08 5.125917843702984e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.4424526 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.719770315532174e-19 } "relaxed-configuration-positions" { "source-value" [ [ 3.3800841 3.4403295 0.7573505 ] [ 0.6568606 3.9582163 3.3552517 ] [ 4.1956924 1.1698384 1.6064055 ] [ 3.8502621 2.0036253 3.9994644 ] [ 3.0785648 4.1566615 3.0919919 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.3800841e-10 3.4403295e-10 7.573505e-11 ] [ 6.568606000000001e-11 3.9582163e-10 3.3552517e-10 ] [ 4.195692400000001e-10 1.1698384e-10 1.6064055e-10 ] [ 3.8502621e-10 2.0036253e-10 3.9994644e-10 ] [ 3.0785648e-10 4.1566615e-10 3.0919919e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-06 8.2e-06 2.04e-05 ] [ -4.3e-06 4.4e-06 3.7e-06 ] [ 9e-06 -1.76e-05 1.4e-06 ] [ -1e-06 6e-06 -1.54e-05 ] [ -2.7e-06 -1.1e-06 -1.01e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.6021766208e-15 1.313784829056e-14 3.268440306432e-14 ] [ -6.889359469440001e-15 7.04957713152e-15 5.928053496960001e-15 ] [ 1.44195895872e-14 -2.819830852608e-14 2.24304726912e-15 ] [ -1.6021766208e-15 9.6130597248e-15 -2.467351996032e-14 ] [ -4.32587687616e-15 -1.76239428288e-15 -1.618198387008e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.649402 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.866439953070076e-18 } }