{ "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" [ [ 1.713643 2.381995 2.341744 ] [ 1.446412 4.331189 1.115178 ] [ 2.556484 4.191275 3.378185 ] [ 3.693858 2.577115 3.453442 ] [ 3.860603 3.859948 1.679861 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.713643e-10 2.381995e-10 2.341744e-10 ] [ 1.446412e-10 4.331189e-10 1.115178e-10 ] [ 2.556484e-10 4.191275e-10 3.378185e-10 ] [ 3.693858e-10 2.577115e-10 3.453442e-10 ] [ 3.860603e-10 3.859948e-10 1.679861e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2359436 -1.0235895 -0.8219805 ] [ 1.1911125 -0.207612 0.6551114 ] [ -5.8997268 8.1332515 1.2515136 ] [ 5.4713812 -7.9298786 2.1435927 ] [ 0.4731767 1.0278286 -3.2282372 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.980199940547387e-09 -1.639971166196362e-09 -1.316957939853494e-09 ] [ 1.90837260024264e-09 -3.326310925975296e-10 1.049604169099557e-09 ] [ -9.452404348067198e-09 1.303090540438653e-08 2.005145830533243e-09 ] [ 8.76611904212465e-09 -1.270506609870224e-08 3.434414108457548e-09 ] [ 7.581126462472954e-10 1.646762953109595e-09 -5.172206168236854e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.410866 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.949745907388161e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8707265 2.3607022 2.23232 ] [ 1.5079965 4.4512622 1.2118289 ] [ 2.383086 4.3567728 3.3955663 ] [ 3.8004036 2.4853462 3.5755344 ] [ 3.7087874 3.6874386 1.5531604 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8707265e-10 2.3607022e-10 2.23232e-10 ] [ 1.5079965e-10 4.451262200000001e-10 1.2118289e-10 ] [ 2.383086e-10 4.3567728e-10 3.3955663e-10 ] [ 3.8004036e-10 2.4853462e-10 3.5755344e-10 ] [ 3.7087874e-10 3.6874386e-10 1.5531604e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.1e-06 -3.6e-06 -3.4e-06 ] [ 1e-06 -1e-06 6.8e-06 ] [ -3.8e-06 5.6e-06 7e-07 ] [ -5e-07 2.3e-06 -2.3e-06 ] [ 5.5e-06 -3.4e-06 -1.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.36457090368e-15 -5.76783583488e-15 -5.44740051072e-15 ] [ 1.6021766208e-15 -1.6021766208e-15 1.089480102144e-14 ] [ -6.08827115904e-15 8.972189076479999e-15 1.12152363456e-15 ] [ -8.010883104e-16 3.68500622784e-15 -3.68500622784e-15 ] [ 8.8119714144e-15 -5.44740051072e-15 -2.88391791744e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.398784 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.268245481754911e-18 } }