{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.5472166e-10 7.521472e-11 2.706931400000001e-10 ] [ 2.8484566e-10 2.3433166e-10 9.223813e-11 ] [ 1.0900886e-10 2.7985653e-10 2.5065278e-10 ] [ 2.3155518e-10 2.3297761e-10 4.659290000000001e-10 ] [ 2.5412315e-10 4.4379541e-10 3.5134738e-10 ] [ 4.3509638e-10 3.545689100000001e-10 2.2887877e-10 ] [ 4.4754442e-10 1.7206846e-10 3.7803617e-10 ] ] "source-value" [ [ 2.5472166 0.7521472 2.7069314 ] [ 2.8484566 2.3433166 0.9223813 ] [ 1.0900886 2.7985653 2.5065278 ] [ 2.3155518 2.3297761 4.65929 ] [ 2.5412315 4.4379541 3.5134738 ] [ 4.3509638 3.5456891 2.2887877 ] [ 4.4754442 1.7206846 3.7803617 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.64671713085824e-12 -2.9039451252e-12 3.35591914992768e-12 ] [ 6.698700451564801e-13 6.8781442330944e-13 -2.5378477673472e-13 ] [ -5.1317717164224e-13 9.092352323039999e-13 1.594165737696e-13 ] [ 6.312575885952001e-13 9.148428504768e-14 -2.79387559135104e-12 ] [ 2.82047172325632e-12 -4.710399265152e-13 -6.413513013062401e-13 ] [ -2.34110047831296e-12 5.6332529987328e-13 3.309616245586561e-12 ] [ -2.91403883791104e-12 1.12280537585664e-12 -3.13578008222976e-12 ] ] "source-value" [ [ 0.0010278 -0.0018125 0.0020946 ] [ 0.0004181 0.0004293 -0.0001584 ] [ -0.0003203 0.0005675 9.95e-05 ] [ 0.000394 5.71e-05 -0.0017438 ] [ 0.0017604 -0.000294 -0.0004003 ] [ -0.0014612 0.0003516 0.0020657 ] [ -0.0018188 0.0007008 -0.0019572 ] ] } "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" -3.59691967875205e-18 "source-value" -22.450207 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.66985862936503e-09 -3.2963689686328e-09 -4.236172449120367e-09 ] [ 6.621065381227316e-10 -2.564057774686868e-10 3.569278607254685e-09 ] [ -1.170458274218446e-09 -1.076088789512029e-09 -4.261270706102861e-09 ] [ -6.072326137092136e-09 -7.493010433335181e-09 1.046461435570793e-08 ] [ 1.645385401651031e-09 1.431464381418436e-08 -6.507006748027889e-09 ] [ -1.978398933807945e-09 6.78607835793337e-10 -2.533422715738212e-09 ] [ 9.58355019492746e-09 -2.871377520811336e-09 3.503979816244374e-09 ] ] "source-value" [ [ -1.6663947 -2.0574317 -2.6440109 ] [ 0.4132544 -0.1600359 2.2277685 ] [ -0.7305426 -0.6716418 -2.659676 ] [ -3.7900479 -4.6767693 6.5314986 ] [ 1.0269688 8.934498 -4.0613542 ] [ -1.2348195 0.4235537 -1.5812381 ] [ 5.9815816 -1.7921729 2.1870122 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.97119728994639e-18 "source-value" -18.544755 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.872972e-10 1.012553e-10 2.780557e-10 ] [ 2.489863e-10 2.81954e-10 4.602746e-11 ] [ 1.064652e-10 2.650766e-10 2.601591e-10 ] [ 2.280466e-10 2.401905e-10 4.700098e-10 ] [ 2.677321e-10 4.010574e-10 3.508674e-10 ] [ 4.446125000000001e-10 3.093023e-10 2.174548e-10 ] [ 4.337554e-10 1.939772e-10 4.152011e-10 ] ] "source-value" [ [ 2.872972 1.012553 2.780557 ] [ 2.489863 2.81954 0.4602746 ] [ 1.064652 2.650766 2.601591 ] [ 2.280466 2.401905 4.700098 ] [ 2.677321 4.010574 3.508674 ] [ 4.446125 3.093023 2.174548 ] [ 4.337554 1.939772 4.152011 ] ] } "instance-id" 1 }