{ "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" [ [ 0.5094065 0.6220131 0.2703167 ] [ 0.4530106 0.160144 2.650194 ] [ 0.6482707 2.949508 2.588273 ] [ 2.962565 0.672996 2.425796 ] [ 1.742585 2.553059 0.6145101 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.094065e-11 6.220131e-11 2.703167e-11 ] [ 4.530106e-11 1.60144e-11 2.650194e-10 ] [ 6.482707e-11 2.949508e-10 2.588273e-10 ] [ 2.962565e-10 6.72996e-11 2.425796e-10 ] [ 1.742585e-10 2.553059e-10 6.145100999999999e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6477709 0.454903 1.8027743 ] [ 2.2291251 2.9750327 -1.5953669 ] [ 0.5706866 -2.9443914 -0.5403 ] [ -3.7490402 1.5288042 -1.4547844 ] [ 0.3014576 -2.0143485 1.7876771 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.037843391614575e-09 7.288349513317825e-10 2.888362836039086e-09 ] [ 3.571452120058462e-09 4.766527838055499e-09 -2.556059548778172e-09 ] [ 9.143407283238414e-10 -4.717435063564582e-09 -8.6565602821824e-10 ] [ -6.006624558879357e-09 2.449414347020847e-09 -2.330821553984556e-09 ] [ 4.82988318882478e-10 -3.227342072843549e-09 2.864174455159543e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.480873 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.999656292777396e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9106625 0.3803904 0.3803212 ] [ 0.2013618 0.4234931 2.6316156 ] [ 0.9757214 2.6445525 2.8330328 ] [ 2.5429226 0.9078955 2.122331 ] [ 1.6851695 2.6013886 0.5817892 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.106625000000001e-11 3.803904e-11 3.803212000000001e-11 ] [ 2.013618e-11 4.234931e-11 2.6316156e-10 ] [ 9.757214e-11 2.6445525e-10 2.8330328e-10 ] [ 2.5429226e-10 9.078955e-11 2.122331e-10 ] [ 1.6851695e-10 2.6013886e-10 5.817892e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.7e-05 -6.41e-05 -4.45e-05 ] [ -1.52e-05 3.42e-05 -7e-06 ] [ 2.45e-05 1.7e-06 5.7e-05 ] [ -5.2e-06 8.7e-06 9.6e-06 ] [ -2.11e-05 1.95e-05 -1.51e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.72370025536e-14 -1.0269952139328e-13 -7.129685962560001e-14 ] [ -2.435308463616e-14 5.479444043136e-14 -1.12152363456e-14 ] [ 3.92533272096e-14 2.72370025536e-15 9.13240673856e-14 ] [ -8.33131842816e-15 1.393893660096e-14 1.538089555968e-14 ] [ -3.380592669888e-14 3.12424441056e-14 -2.419286697408e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.50509 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.323971608059987e-18 } }