{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.9739649e-10 7.213352e-11 -6.496051000000001e-11 ] [ 2.0478983e-10 2.1780443e-10 2.6267653e-10 ] [ 1.7159952e-10 1.2874886e-10 4.6114465e-10 ] [ 2.0181896e-10 1.7912729e-10 6.725520600000001e-10 ] [ 5.1788435e-10 1.5577979e-10 2.7658487e-10 ] [ 3.6616718e-10 1.7554939e-10 1.1787687e-10 ] [ 5.1357797e-10 1.0619097e-10 4.9107963e-10 ] ] "source-value" [ [ 2.9739649 0.7213352 -0.6496051 ] [ 2.0478983 2.1780443 2.6267653 ] [ 1.7159952 1.2874886 4.6114465 ] [ 2.0181896 1.7912729 6.7255206 ] [ 5.1788435 1.5577979 2.7658487 ] [ 3.6616718 1.7554939 1.1787687 ] [ 5.1357797 1.0619097 4.9107963 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 9.001981550743775e-10 7.883329016688249e-10 8.672314484894727e-10 ] [ -4.277153082944851e-10 -1.915354084867776e-11 1.217200815824314e-10 ] [ -2.92727602115209e-10 4.43103894301945e-10 2.376386816209459e-10 ] [ -5.976295035012288e-11 -1.636147571690822e-10 3.989953310606727e-10 ] [ 7.390268774696775e-10 -2.529083861231424e-10 7.100741039728627e-10 ] [ -1.202351362249753e-09 -8.819987104033864e-10 -2.122850376850963e-09 ] [ 3.433321904655149e-10 8.623859857351872e-11 -2.128092698754221e-10 ] ] "source-value" [ [ 0.5618595 0.4920387 0.5412833 ] [ -0.2669589 -0.0119547 0.0759717 ] [ -0.1827062 0.2765637 0.1483224 ] [ -0.0373011 -0.1021203 0.2490333 ] [ 0.4612643 -0.157853 0.4431934 ] [ -0.7504487 -0.5505003 -1.324979 ] [ 0.2142911 0.0538259 -0.1328251 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.411821035008058e-18 "source-value" -15.053403 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.005930869180857e-08 1.211786580369644e-08 2.279942672996769e-09 ] [ 7.760577133362024e-09 2.390569924527429e-09 -7.334156704212469e-09 ] [ -2.84240231684183e-10 -3.983682391312915e-10 4.456600068827693e-10 ] [ 0.0 0.0 0.0 ] [ -3.675059434725087e-09 6.2942509908516e-09 1.649803403682887e-09 ] [ -1.438683260553476e-08 -1.824384499059528e-08 8.230756851249515e-09 ] [ 5.262464467734298e-10 -2.160473329131237e-09 -5.272006230599473e-09 ] ] "source-value" [ [ 6.2785267 7.563377 1.4230283 ] [ 4.8437713 1.4920764 -4.5776206 ] [ -0.1774088 -0.2486419 0.2781591 ] [ 0.0 0.0 0.0 ] [ -2.2937917 3.9285625 1.0297263 ] [ -8.9795547 -11.3869125 5.1372344 ] [ 0.3284572 -1.3484614 -3.2905275 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.360773400903758e-18 "source-value" -8.4932796 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.69276e-10 7.489354e-11 1.12344e-10 ] [ 2.32609e-10 2.279725e-10 3.013569e-10 ] [ 2.388377e-10 2.175567e-11 3.770382e-10 ] [ 2.168931e-10 2.205605e-10 5.63033e-10 ] [ 4.690190000000001e-10 7.206414e-11 2.589749e-10 ] [ 3.957875e-10 2.675588e-10 1.380487e-10 ] [ 4.50812e-10 1.505291e-10 4.661584000000001e-10 ] ] "source-value" [ [ 2.69276 0.7489354 1.12344 ] [ 2.32609 2.279725 3.013569 ] [ 2.388377 0.2175567 3.770382 ] [ 2.168931 2.205605 5.63033 ] [ 4.69019 0.7206414 2.589749 ] [ 3.957875 2.675588 1.380487 ] [ 4.50812 1.505291 4.661584 ] ] } "instance-id" 1 }