{ "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" [ [ 0.6678483 0.3705928 0.1642866 ] [ 0.4651457 2.25942 0.9775642 ] [ 2.325854 0.8972553 0.6909246 ] [ 2.51877 2.867173 0.7641457 ] [ 2.596702 2.283556 2.674442 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.678483e-11 3.705928e-11 1.642866e-11 ] [ 4.651457e-11 2.25942e-10 9.775642000000001e-11 ] [ 2.325854e-10 8.972553e-11 6.909246e-11 ] [ 2.51877e-10 2.867173e-10 7.641457000000001e-11 ] [ 2.596702e-10 2.283556e-10 2.674442e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.4272127 -3.3896345 -1.8688542 ] [ -2.9442186 2.751112 1.3621648 ] [ 3.3455334 -3.1427378 0.2602263 ] [ 1.8930873 4.4142364 -2.6387789 ] [ 0.1328106 -0.6329762 2.8852419 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.888823473688052e-09 -5.430793193700273e-09 -2.994234531592762e-09 ] [ -4.717158246308192e-09 4.407767363917007e-09 2.182428614217283e-09 ] [ 5.360135441746575e-09 -5.035221069948564e-09 4.169284974122742e-10 ] [ 3.033060238182148e-09 7.072386417032277e-09 -4.227789895872222e-09 ] [ 2.127860400675204e-10 -1.014139677518111e-09 4.622667155617764e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.985409 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.760056561473331e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8278164 0.8174736 -0.0790745 ] [ 0.2376932 2.458384 1.5123017 ] [ 2.9000545 0.5078001 1.0086895 ] [ 2.2988595 2.7456871 0.2293337 ] [ 2.3098965 2.1486523 2.6001127 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.278164e-11 8.174736e-11 -7.907450000000001e-12 ] [ 2.376932e-11 2.458384e-10 1.5123017e-10 ] [ 2.9000545e-10 5.078001e-11 1.0086895e-10 ] [ 2.2988595e-10 2.7456871e-10 2.293337e-11 ] [ 2.3098965e-10 2.1486523e-10 2.6001127e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.3e-06 2.1e-05 6.4e-06 ] [ -2.34e-05 -2.6e-06 5.8e-06 ] [ 9.3e-06 -7e-06 1.82e-05 ] [ 2e-06 -7.4e-06 2e-05 ] [ 5.8e-06 -4e-06 -5.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.00937127942e-14 3.364570931399999e-14 1.02539304576e-14 ] [ -3.749093323559999e-14 -4.165659248399999e-15 9.2926244772e-15 ] [ 1.49002426962e-14 -1.1215236438e-14 2.915961473879999e-14 ] [ 3.204353268e-15 -1.18561070916e-14 3.204353268e-14 ] [ 9.2926244772e-15 -6.408706535999999e-15 -8.090992001699999e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.50509 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.323971627206706e-18 } }