{ "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" [ [ 0.0450915 0.6744384 2.108849 ] [ 0.1091138 2.224666 0.3426204 ] [ 1.10319 2.788623 2.698849 ] [ 2.780637 1.123883 1.270131 ] [ 2.821139 0.9081744 2.973557 ] [ 2.438974 2.484533 0.05951 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.50915e-12 6.744384e-11 2.108849e-10 ] [ 1.091138e-11 2.224666e-10 3.426204e-11 ] [ 1.10319e-10 2.788623e-10 2.698849e-10 ] [ 2.780637e-10 1.123883e-10 1.270131e-10 ] [ 2.821139e-10 9.081744000000001e-11 2.973557e-10 ] [ 2.438974e-10 2.484533e-10 5.951e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.868516 -8.5979214 1.7708633 ] [ -12.1607482 4.3337674 -10.7522687 ] [ -7.3176006 15.7491245 17.5474832 ] [ 22.4050372 -18.6997932 -17.4483548 ] [ 7.8197524 -4.2987543 24.5228625 ] [ 2.1220753 11.513577 -15.6405855 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.061763547959073e-08 -1.377538865455601e-08 2.837235777892737e-09 ] [ -1.948366645747568e-08 6.943460808265202e-09 -1.722703353169961e-08 ] [ -1.172408860167205e-08 2.523287907196849e-08 2.811416733692077e-08 ] [ 3.589682678999429e-08 -2.996037147883482e-08 -2.795534613198346e-08 ] [ 1.252862447572469e-08 -6.887363638023469e-09 3.928995697259304e-08 ] [ 3.399939433237146e-09 1.84467838911806e-08 -2.505898042372348e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 6.7597676 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.083034161076133e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.5376846 1.3318514 2.0564666 ] [ -0.0220543 2.0459537 -0.1240236 ] [ 1.0034967 2.2606743 3.5705343 ] [ 3.4601019 0.8561227 0.9743914 ] [ 3.1065857 1.253658 3.2651001 ] [ 2.2876998 2.4560577 -0.2889525 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.376846e-11 1.3318514e-10 2.0564666e-10 ] [ -2.20543e-12 2.0459537e-10 -1.240236e-11 ] [ 1.0034967e-10 2.2606743e-10 3.5705343e-10 ] [ 3.4601019e-10 8.561227000000001e-11 9.743914000000001e-11 ] [ 3.1065857e-10 1.253658e-10 3.2651001e-10 ] [ 2.2876998e-10 2.4560577e-10 -2.889525e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.9e-06 -8e-07 -2e-06 ] [ -8.1e-06 -2.6e-06 1.2e-06 ] [ 5.1e-06 -8e-07 -4.7e-06 ] [ -8e-06 3.1e-06 -3.7e-06 ] [ -2.5e-06 2.3e-06 1.6e-06 ] [ 1.06e-05 -1.2e-06 7.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.646312200320001e-15 -1.28174129664e-15 -3.2043532416e-15 ] [ -1.297763062848e-14 -4.16565921408e-15 1.92261194496e-15 ] [ 8.17110076608e-15 -1.28174129664e-15 -7.53023011776e-15 ] [ -1.28174129664e-14 4.96674752448e-15 -5.928053496960001e-15 ] [ -4.005441552e-15 3.68500622784e-15 2.56348259328e-15 ] [ 1.698307218048e-14 -1.92261194496e-15 1.233675998016e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.0092 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.084303609531136e-18 } }