{ "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" [ [ 0.148581 1.499098 2.912634 ] [ 0.4436014 1.560152 0.6683764 ] [ 2.110053 0.4783189 0.3653162 ] [ 2.063967 1.021193 2.434749 ] [ 2.249538 2.67297 1.348927 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.48581e-11 1.499098e-10 2.912634e-10 ] [ 4.436014e-11 1.560152e-10 6.683764e-11 ] [ 2.110053e-10 4.783189e-11 3.653162e-11 ] [ 2.063967e-10 1.021193e-10 2.434749e-10 ] [ 2.249538e-10 2.67297e-10 1.348927e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.6448601 1.0214497 13.1822873 ] [ -15.8821829 2.6314653 -11.7221544 ] [ 8.7517427 -12.9839151 -13.3611842 ] [ 10.8598993 -8.8018311 14.4530067 ] [ 9.915401 18.1328312 -2.5519553 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.186147584630675e-08 1.636542828663174e-09 2.112035252072876e-08 ] [ -2.544606212964954e-08 4.216072182106458e-09 -1.878096172508785e-08 ] [ 1.402183754519707e-08 -2.08025252196721e-08 -2.140697695144235e-08 ] [ 1.739947676270229e-08 -1.410208800865035e-08 2.315626943500576e-08 ] [ 1.588622366805694e-08 2.905199821755281e-08 -4.08868311898665e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 94.226254 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.509671012243625e-17 } "relaxed-configuration-positions" { "source-value" [ [ -3.709157 2.1089643 6.84571 ] [ -3.8483857 2.5369806 -3.1441555 ] [ 4.5254699 -2.9265321 -3.3131803 ] [ 5.6561177 -1.3800495 6.5016057 ] [ 4.3916955 6.8923685 0.8400227 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.709157e-10 2.1089643e-10 6.845710000000001e-10 ] [ -3.8483857e-10 2.5369806e-10 -3.1441555e-10 ] [ 4.5254699e-10 -2.9265321e-10 -3.3131803e-10 ] [ 5.6561177e-10 -1.3800495e-10 6.5016057e-10 ] [ 4.3916955e-10 6.8923685e-10 8.400227e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 0.0 0.0 ] [ -0.0 0.0 -0.0 ] [ 0.0 -0.0 -0.0 ] [ 0.0 -0.0 0.0 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 0.0 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 0.0 } }