{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.5419945 1.059703 1.497036 ] [ 0.5287309 2.297187 0.1799033 ] [ 1.173246 2.181689 2.79912 ] [ 2.288869 1.000101 0.1162968 ] [ 2.25753 0.9328521 1.885741 ] [ 2.965412 2.910996 0.3877363 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.419945000000001e-11 1.059703e-10 1.497036e-10 ] [ 5.287309e-11 2.297187e-10 1.799033e-11 ] [ 1.173246e-10 2.181689e-10 2.79912e-10 ] [ 2.288869e-10 1.000101e-10 1.162968e-11 ] [ 2.25753e-10 9.328521e-11 1.885741e-10 ] [ 2.965412e-10 2.910996e-10 3.877363e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -52.3389357 -26.1333753 -1.7520024 ] [ -6.076634 18.9266355 -15.0779548 ] [ -5.3533027 32.3265777 33.4723971 ] [ 18.8712158 -11.0320432 -32.9992653 ] [ 44.327939 -19.830823 16.595662 ] [ 0.5697176 5.7430283 -0.2388367 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.385621913609448e-08 -4.187028292825219e-08 -2.80701728486549e-09 ] [ -9.735840927958388e-09 3.032381290850332e-08 -2.415754667003914e-08 ] [ -8.576936430005516e-09 5.179288702141464e-08 5.362869207575373e-08 ] [ 3.023502076083157e-08 -1.767528169469562e-08 -5.287065136723669e-08 ] [ 7.102118751404853e-08 -3.177248098182292e-08 2.658918166309897e-08 ] [ 9.127882191782862e-10 9.201345674852768e-09 -3.826585769290234e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 19.778902080918062 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.168929449913939e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.379058 0.5961127 1.4635538 ] [ 0.5480919 2.6404991 0.1679323 ] [ 1.1497726 2.6406308 2.5183902 ] [ 2.1021489 0.8202119 -0.2297787 ] [ 2.7038374 0.8203498 2.1206809 ] [ 2.8728735 2.8647238 0.8250548 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.79058e-11 5.961127000000001e-11 1.4635538e-10 ] [ 5.480919e-11 2.6404991e-10 1.679323e-11 ] [ 1.1497726e-10 2.6406308e-10 2.5183902e-10 ] [ 2.1021489e-10 8.202119000000001e-11 -2.297787e-11 ] [ 2.7038374e-10 8.203498e-11 2.1206809e-10 ] [ 2.8728735e-10 2.8647238e-10 8.250548e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.82e-05 3.16e-05 3.24e-05 ] [ -2e-07 -2.45e-05 -1.1e-06 ] [ -9.1e-06 -2.1e-05 1.92e-05 ] [ 3.19e-05 2.9e-06 -5.2e-05 ] [ -5.8e-06 -3.5e-06 1.74e-05 ] [ 1.13e-05 1.45e-05 -1.61e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.518138070656001e-14 5.062878121728e-14 5.191052251392001e-14 ] [ -3.2043532416e-16 -3.92533272096e-14 -1.76239428288e-15 ] [ -1.457980724928e-14 -3.36457090368e-14 3.076179111936e-14 ] [ 5.110943420352001e-14 4.646312200320001e-15 -8.33131842816e-14 ] [ -9.292624400640001e-15 -5.6076181728e-15 2.787787320192e-14 ] [ 1.810459581504e-14 2.32315610016e-14 -2.579504359488e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.737433279081937 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.079455808394496e-18 } }