{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.891577 1.147444 4.176951 ] [ 1.947528 5.315412 2.001915 ] [ 3.037668 3.274696 0.9821769 ] [ 1.344392 3.383525 2.90788 ] [ 3.679276 1.837825 2.704146 ] [ 4.016034 4.351153 3.141989 ] [ 3.129852 3.103182 4.716137 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.891577e-10 1.147444e-10 4.176951e-10 ] [ 1.947528e-10 5.315412000000001e-10 2.001915e-10 ] [ 3.037668e-10 3.274696e-10 9.821769000000001e-11 ] [ 1.344392e-10 3.383525e-10 2.90788e-10 ] [ 3.679276000000001e-10 1.837825e-10 2.704146e-10 ] [ 4.016034e-10 4.351153e-10 3.141989e-10 ] [ 3.129852e-10 3.103182e-10 4.716137e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0885665 0.3845892 -0.5149811 ] [ 1.3095978 0.4813216 -0.3002908 ] [ -0.4221688 0.6286992 0.3758364 ] [ -0.4824553 -1.6808224 0.8564327 ] [ 0.398801 -0.3576604 0.0493722 ] [ 0.1885673 1.0066916 -1.8205296 ] [ -0.9037754 -0.4628188 1.3541602 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.418991756860832e-10 6.161798248521754e-10 -8.250906785738668e-10 ] [ 2.098206977811114e-09 7.711622146060493e-10 -4.811188992013287e-10 ] [ -6.763889813911911e-10 1.007287159755663e-09 6.021562933256371e-10 ] [ -7.729786022410503e-10 -2.692974352996946e-09 1.37215644922862e-09 ] [ 6.389496385516609e-10 -5.730351310659762e-10 7.910298455746175e-11 ] [ 3.021181195073799e-10 1.612897745875745e-09 -2.916809962594376e-09 ] [ -1.448007816334168e-09 -7.415174610267109e-10 2.169603813257852e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -23.356102 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.742060057742013e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3790134 1.558741 3.9437466 ] [ 2.452245 4.9540581 2.4424029 ] [ 2.3998482 3.0173875 1.0309248 ] [ 0.8815953 3.1015252 2.8839067 ] [ 4.0453545 1.92931 2.3195287 ] [ 4.4517779 4.003469 3.3610619 ] [ 2.4364927 3.8487463 4.6496233 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3790134e-10 1.558741e-10 3.9437466e-10 ] [ 2.452245e-10 4.9540581e-10 2.4424029e-10 ] [ 2.3998482e-10 3.0173875e-10 1.0309248e-10 ] [ 8.815953e-11 3.1015252e-10 2.8839067e-10 ] [ 4.0453545e-10 1.92931e-10 2.3195287e-10 ] [ 4.4517779e-10 4.003469e-10 3.3610619e-10 ] [ 2.4364927e-10 3.8487463e-10 4.6496233e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.5e-06 -0.0 -9.9e-06 ] [ 1.1e-06 6.6e-06 -1.08e-05 ] [ -1.38e-05 -4.8e-06 3.1e-06 ] [ -5e-06 -1.9e-05 5.7e-06 ] [ -4.2e-06 1.78e-05 5e-07 ] [ 3.17e-05 -8.3e-06 1.82e-05 ] [ -4.4e-06 7.7e-06 -6.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.8119714144e-15 0.0 -1.586154854592e-14 ] [ 1.76239428288e-15 1.057436569728e-14 -1.730350750464e-14 ] [ -2.211003736704e-14 -7.69044777984e-15 4.96674752448e-15 ] [ -8.010883104e-15 -3.04413557952e-14 9.13240673856e-15 ] [ -6.72914180736e-15 2.851874385024e-14 8.010883104e-16 ] [ 5.078899887936e-14 -1.329806595264e-14 2.915961449856e-14 ] [ -7.04957713152e-15 1.233675998016e-14 -1.089480102144e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.660576 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.951059832266158e-18 } }