{ "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" [ [ 0.635409 0.2945373 0.4894103 ] [ 0.6913641 0.4672635 2.355287 ] [ 2.952385 0.4157679 2.192681 ] [ 2.385934 1.774442 0.4759126 ] [ 2.093707 2.943435 1.550224 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.35409e-11 2.945373e-11 4.894103e-11 ] [ 6.913641e-11 4.672635e-11 2.355287e-10 ] [ 2.952385e-10 4.157679e-11 2.192681e-10 ] [ 2.385934000000001e-10 1.774442e-10 4.759126e-11 ] [ 2.093707e-10 2.943435e-10 1.550224e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.5540849 -1.5631931 -17.4305663 ] [ -9.2109024 -7.2525883 22.4841181 ] [ 7.9145638 -5.3126746 5.7466713 ] [ 13.1659052 -19.7264357 -32.187578 ] [ -6.3154817 33.8548917 21.3873549 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.898624976718307e-09 -2.504511438615876e-09 -2.792684581316436e-08 ] [ -1.475749248175061e-08 -1.161992741454762e-08 3.602352835912611e-08 ] [ 1.268052908419001e-08 -8.511843038037991e-09 9.207182404282342e-09 ] [ 2.109410550310915e-08 -3.160523409025448e-08 -5.157018495177643e-08 ] [ -1.011851712883024e-08 5.424151598145598e-08 3.426632000153232e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 2.9268061 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.689260307034827e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.2490614 0.5936141 0.5087548 ] [ 0.8353037 -0.8875283 2.277247 ] [ 2.8611816 0.3157242 2.613456 ] [ 2.2749262 1.7968851 0.8449784 ] [ 2.5383262 4.0767506 0.8190787 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.490614e-11 5.936141e-11 5.087548e-11 ] [ 8.353037e-11 -8.875283000000001e-11 2.277247e-10 ] [ 2.8611816e-10 3.157242e-11 2.613456e-10 ] [ 2.2749262e-10 1.7968851e-10 8.449784e-11 ] [ 2.5383262e-10 4.076750599999999e-10 8.190787e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.5e-06 1.18e-05 1.55e-05 ] [ 1.37e-05 -1.9e-06 -4.9e-06 ] [ -2.11e-05 3.46e-05 -1.9e-06 ] [ -1.7e-06 -5.79e-05 -3.35e-05 ] [ 5.5e-06 1.34e-05 2.48e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.6076181728e-15 1.890568412544e-14 2.48337376224e-14 ] [ 2.194981970496e-14 -3.04413557952e-15 -7.850665441919999e-15 ] [ -3.380592669888e-14 5.543531107968001e-14 -3.04413557952e-15 ] [ -2.72370025536e-15 -9.276602634432e-14 -5.36729167968e-14 ] [ 8.8119714144e-15 2.146916671872e-14 3.973398019584e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.303887 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.811082347556505e-18 } }