{ "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" [ [ 2.026773 2.5022 1.482523 ] [ 1.327692 1.758529 3.84576 ] [ 1.586091 4.007002 3.406328 ] [ 4.160839 1.404559 1.89873 ] [ 3.792152 2.753975 4.110825 ] [ 3.943377 3.908391 2.363825 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.026773e-10 2.5022e-10 1.482523e-10 ] [ 1.327692e-10 1.758529e-10 3.84576e-10 ] [ 1.586091e-10 4.007002e-10 3.406328e-10 ] [ 4.160839e-10 1.404559e-10 1.89873e-10 ] [ 3.792152e-10 2.753975e-10 4.110825e-10 ] [ 3.943377e-10 3.908391e-10 2.363825e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.1968141 1.7270901 9.2310351 ] [ 5.0968115 5.0103917 -4.0768136 ] [ 6.6155363 -6.8426822 -3.1223913 ] [ -4.9205738 7.319043 3.4016872 ] [ -6.6320804 -6.993958 3.3019792 ] [ -5.3565077 -0.2198846 -8.7354965 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.326214053663794e-09 2.767103380235134e-09 1.478974862300419e-08 ] [ 8.16599222592458e-09 8.027532442790366e-09 -6.531775437279484e-09 ] [ 1.059925759391373e-08 -1.096318544440431e-08 -5.002622341849319e-09 ] [ -7.883628303281014e-09 1.172639958122989e-08 5.450103703114614e-09 ] [ -1.062576416414591e-08 -1.120555599445713e-08 5.290353876607887e-09 ] [ -8.58207140607518e-09 -3.522939653939597e-10 -1.399580826338023e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -26.32778 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.218175359356583e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9749612 2.6678265 1.529071 ] [ 1.8493986 1.6684625 3.4962978 ] [ 1.8918375 3.8749962 3.3784777 ] [ 3.7204701 1.5698889 2.3241857 ] [ 3.6373468 2.7770596 4.1735928 ] [ 3.7629098 3.7764223 2.206366 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9749612e-10 2.6678265e-10 1.529071e-10 ] [ 1.8493986e-10 1.6684625e-10 3.4962978e-10 ] [ 1.8918375e-10 3.8749962e-10 3.3784777e-10 ] [ 3.7204701e-10 1.5698889e-10 2.3241857e-10 ] [ 3.6373468e-10 2.7770596e-10 4.1735928e-10 ] [ 3.7629098e-10 3.7764223e-10 2.206366e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.6e-06 -2.56e-05 8e-06 ] [ -8.7e-06 6.9e-06 5e-07 ] [ 1.32e-05 2.8e-06 1.31e-05 ] [ 1.5e-06 9.7e-06 1.13e-05 ] [ -1.92e-05 -1.97e-05 -2.58e-05 ] [ 7.6e-06 2.58e-05 -7.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.972189076479999e-15 -4.101572149248001e-14 1.28174129664e-14 ] [ -1.393893660096e-14 1.105501868352e-14 8.010883104e-16 ] [ 2.114873139456e-14 4.48609453824e-15 2.098851373248e-14 ] [ 2.4032649312e-15 1.554111322176e-14 1.810459581504e-14 ] [ -3.076179111936e-14 -3.156287942976e-14 -4.133615681664e-14 ] [ 1.217654231808e-14 4.133615681664e-14 -1.153567166976e-14 ] ] } "relaxed-potential-energy" { "source-value" -40.305538 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.457659067236599e-18 } }