{ "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" [ [ 4.4006135 0.4003082 0.4479063 ] [ 2.0347325 -0.1198584 1.6569512 ] [ 2.0476265 -2.4763221 -4.0788915 ] [ -1.7662031 -9.637704 -13.3508073 ] [ -3.2893936 0.99663 19.156102 ] [ -3.4273758 10.8369463 -3.8312607 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.050560066876862e-09 6.413644391545305e-10 7.17625002169031e-10 ] [ 3.260000841081936e-09 -1.920343262864947e-10 2.654728474446505e-09 ] [ 3.280659306430531e-09 -3.96750537419036e-09 -6.535104600079844e-09 ] [ -2.829769314404485e-09 -1.544130402699064e-08 -2.139035132486597e-08 ] [ -5.270189522529147e-09 1.596777285587904e-09 3.069145877006012e-08 ] [ -5.491261377455697e-09 1.736270200272506e-08 -6.138356321729843e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.041582 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.929274115784611e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3369054 0.6018538 2.3382518 ] [ 0.2620577 1.9645146 0.3376761 ] [ 1.4638234 2.7761596 2.3113193 ] [ 2.355523 0.8657275 0.9766957 ] [ 2.5013857 0.8790004 3.3876797 ] [ 2.3784502 3.1170618 0.1018939 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.369054e-11 6.018538e-11 2.3382518e-10 ] [ 2.620577e-11 1.9645146e-10 3.376761e-11 ] [ 1.4638234e-10 2.7761596e-10 2.3113193e-10 ] [ 2.355523e-10 8.657275e-11 9.766957000000001e-11 ] [ 2.5013857e-10 8.790004e-11 3.3876797e-10 ] [ 2.3784502e-10 3.1170618e-10 1.018939e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.3e-06 -5.8e-06 -3.6e-06 ] [ -2.81e-05 -8.5e-06 -6e-06 ] [ 2e-06 1.11e-05 -2.66e-05 ] [ -1.11e-05 5.1e-06 -1.85e-05 ] [ 2.07e-05 -5.6e-06 3.17e-05 ] [ 1.98e-05 3.6e-06 2.3e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.28718284864e-15 -9.292624400640001e-15 -5.76783583488e-15 ] [ -4.502116304448e-14 -1.36185012768e-14 -9.6130597248e-15 ] [ 3.2043532416e-15 1.778416049088e-14 -4.261789811328e-14 ] [ -1.778416049088e-14 8.17110076608e-15 -2.96402674848e-14 ] [ 3.316505605055999e-14 -8.972189076479999e-15 5.078899887936e-14 ] [ 3.172309709184e-14 5.76783583488e-15 3.68500622784e-14 ] ] } "relaxed-potential-energy" { "source-value" -23.902638 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.829624777904567e-18 } }