{ "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" [ [ 0.9701738 0.435353 0.8614305 ] [ 0.785215 2.880742 2.663197 ] [ 2.41347 1.4145 0.9828772 ] [ 2.657499 1.219941 2.828683 ] [ 1.63309 2.566255 0.271655 ] [ 2.657105 2.943765 2.654332 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.701738e-11 4.35353e-11 8.614305e-11 ] [ 7.85215e-11 2.880742e-10 2.663197e-10 ] [ 2.41347e-10 1.4145e-10 9.828772e-11 ] [ 2.657499e-10 1.219941e-10 2.828683e-10 ] [ 1.63309e-10 2.566255e-10 2.71655e-11 ] [ 2.657105e-10 2.943765e-10 2.654332e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.9172652 -18.4437837 -5.2311176 ] [ -19.2063892 8.5149215 8.8295747 ] [ 19.0486555 -10.6194871 -9.9091304 ] [ 9.1615222 -17.7271605 18.1533936 ] [ -7.5196582 18.263147 -20.8250741 ] [ 14.433135 20.0123628 8.9823538 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.550227017051344e-08 -2.955019904323212e-08 -8.381174319375406e-09 ] [ -3.077202774622562e-08 1.364240815524727e-08 1.414653815594717e-08 ] [ 3.051931049977333e-08 -1.701429395650719e-08 -1.587617705933855e-08 ] [ 1.467837667978018e-08 -2.840204210626924e-08 2.908494281410035e-08 ] [ -1.204782056444701e-08 2.926078714563366e-08 -3.33654468494476e-08 ] [ 2.312443146185021e-08 3.206333980512763e-08 1.439131725811404e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 96.974425 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.55370156550523e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.5502254 -1.055529 0.4881168 ] [ -1.1132375 3.4070638 3.6532839 ] [ 4.7263858 0.4422486 -0.4068332 ] [ 3.0423287 -0.3501845 4.7686862 ] [ 0.8314793 4.1806577 -1.4575476 ] [ 4.1798219 4.8362994 3.2164686 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.502254e-11 -1.055529e-10 4.881168e-11 ] [ -1.1132375e-10 3.4070638e-10 3.6532839e-10 ] [ 4.7263858e-10 4.422486e-11 -4.068332e-11 ] [ 3.0423287e-10 -3.501845e-11 4.768686200000001e-10 ] [ 8.314793000000001e-11 4.180657700000001e-10 -1.4575476e-10 ] [ 4.1798219e-10 4.8362994e-10 3.2164686e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 -0.0 -0.0 ] [ -0.0 0.0 0.0 ] [ 0.0 -0.0 -0.0 ] [ -0.0 -0.0 0.0 ] [ -0.0 0.0 -0.0 ] [ 0.0 0.0 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" -2.6645353e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.269056162956315e-34 } }