{ "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" [ [ 1.569029 2.409456 2.459016 ] [ 1.280031 0.1374919 2.779238 ] [ 3.588101 1.133333 2.932926 ] [ 4.931515 2.722575 2.426382 ] [ 3.330231 3.38172 3.93095 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.569029e-10 2.409456e-10 2.459016e-10 ] [ 1.280031e-10 1.374919e-11 2.779238e-10 ] [ 3.588101e-10 1.133333e-10 2.932926e-10 ] [ 4.931515000000001e-10 2.722575e-10 2.426382e-10 ] [ 3.330231e-10 3.38172e-10 3.93095e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.319621 0.869727 0.5599313 ] [ 0.3307 0.2626003 -0.0410895 ] [ -1.2441114 -4.4767699 0.3390752 ] [ 2.5357061 2.2408944 -1.0425548 ] [ -1.3026738 1.1035482 0.1846378 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.120892937167168e-10 1.393456265878522e-09 8.971088381141512e-10 ] [ 5.298398084985599e-10 4.207320612750663e-10 -6.58326362603616e-11 ] [ -1.993286198750757e-09 -7.172576070481154e-09 5.432583581330841e-10 ] [ 4.062649030639947e-09 3.590308617361644e-09 -1.67035692646282e-09 ] [ -2.087113506888695e-09 1.768079125965923e-09 2.958223664759462e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.376466 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.98292844733261e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1464716 2.6586431 3.038739 ] [ 1.7063508 0.4971724 2.6338984 ] [ 3.970789 0.3530201 2.6046644 ] [ 4.8104094 2.425405 2.9914079 ] [ 3.0648863 3.8503353 3.2598022 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1464716e-10 2.6586431e-10 3.038739e-10 ] [ 1.7063508e-10 4.971724e-11 2.6338984e-10 ] [ 3.970789e-10 3.530201e-11 2.6046644e-10 ] [ 4.810409400000001e-10 2.425405e-10 2.9914079e-10 ] [ 3.0648863e-10 3.8503353e-10 3.2598022e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.34e-05 -1.41e-05 1.61e-05 ] [ 2.7e-06 1.17e-05 -2.1e-06 ] [ -9.7e-06 5.9e-06 -1.06e-05 ] [ -1.5e-06 -3.2e-06 2.27e-05 ] [ -5e-06 -2e-07 -2.6e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.146916671872e-14 -2.259069035328e-14 2.579504359488e-14 ] [ 4.32587687616e-15 1.874546646336e-14 -3.36457090368e-15 ] [ -1.554111322176e-14 9.45284206272e-15 -1.698307218048e-14 ] [ -2.4032649312e-15 -5.126965186560001e-15 3.636940929216e-14 ] [ -8.010883104e-15 -3.2043532416e-16 -4.16565921408e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.066442 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.41391011310392e-18 } }