{ "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" [ [ 0.1515051 0.6129927 0.4125648 ] [ 0.5354239 0.8367141 2.920626 ] [ 0.0380374 2.448484 2.393252 ] [ 2.476891 0.0370714 1.494005 ] [ 2.980221 0.9767319 2.515602 ] [ 2.390623 2.921281 2.114549 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.515051e-11 6.129927e-11 4.125648000000001e-11 ] [ 5.354239e-11 8.367141000000001e-11 2.920626e-10 ] [ 3.80374e-12 2.448484e-10 2.393252e-10 ] [ 2.476891e-10 3.707139999999999e-12 1.494005e-10 ] [ 2.980221e-10 9.767319e-11 2.515602e-10 ] [ 2.390623e-10 2.921281e-10 2.114549e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0291952 0.4216258 1.2144725 ] [ 6.7277424 -21.549694 6.7855557 ] [ -9.8349585 23.3116826 -7.7078045 ] [ -20.7116762 -39.8647026 -44.4307364 ] [ 25.9281244 32.4344679 45.6090405 ] [ -2.1384272 5.2466203 -1.4705278 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.67758672649568e-11 6.755190050515571e-10 1.945799462135565e-09 ] [ 1.077903167285108e-08 -3.452641619664999e-08 1.087165879124551e-08 ] [ -1.575734070505969e-08 3.734943316094437e-08 -1.234926426934005e-08 ] [ -3.318376365861391e-08 -6.387029502707905e-08 -7.118588769149328e-08 ] [ 4.154143507712527e-08 5.196574660560305e-08 7.307373898825966e-08 ] [ -3.426138093350045e-09 8.40601245213007e-09 -2.356045280807425e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 6.9581165 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.114813167294986e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.0324117 0.5627888 0.6591629 ] [ 0.9638381 0.8479059 2.9300465 ] [ -0.0169682 2.738976 1.6779884 ] [ 2.1400487 -0.4604444 1.1949651 ] [ 3.3932516 1.0833577 2.544929 ] [ 2.0601194 3.0606912 2.8435068 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.24117e-12 5.627888e-11 6.591629000000001e-11 ] [ 9.638381000000001e-11 8.479059e-11 2.9300465e-10 ] [ -1.69682e-12 2.738976e-10 1.6779884e-10 ] [ 2.1400487e-10 -4.604444e-11 1.1949651e-10 ] [ 3.3932516e-10 1.0833577e-10 2.544929e-10 ] [ 2.0601194e-10 3.0606912e-10 2.8435068e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.16e-05 6.8e-06 -1.14e-05 ] [ 3.4e-05 -5.3e-06 -8.3e-06 ] [ -4.81e-05 1.69e-05 1.04e-05 ] [ 2.74e-05 2.1e-06 6.1e-06 ] [ -2.79e-05 -2.16e-05 2.74e-05 ] [ 2.63e-05 1e-06 -2.42e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.85852489544e-14 1.08948011112e-14 -1.82648136276e-14 ] [ 5.447400555599999e-14 -8.4915361602e-15 -1.32980660622e-14 ] [ -7.706469609539999e-14 2.70767851146e-14 1.66626369936e-14 ] [ 4.389963977159999e-14 3.364570931399999e-15 9.773277467399999e-15 ] [ -4.470072808859999e-14 -3.46070152944e-14 4.389963977159999e-14 ] [ 4.21372454742e-14 1.602176634e-15 -3.877267454279999e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.538269 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.970158142660654e-18 } }