{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.18156 2.402287 4.241396 ] [ 0.8961477 3.559566 3.04631 ] [ 5.464384 2.707991 2.659357 ] [ 3.611912 1.298545 2.707748 ] [ 3.448769 3.905478 2.40265 ] [ 4.321729 3.291274 4.492065 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.18156e-10 2.402287e-10 4.241396e-10 ] [ 8.961477e-11 3.559566e-10 3.04631e-10 ] [ 5.464384e-10 2.707991e-10 2.659357e-10 ] [ 3.611912e-10 1.298545e-10 2.707748e-10 ] [ 3.448769e-10 3.905478e-10 2.40265e-10 ] [ 4.321729000000001e-10 3.291274e-10 4.492065e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5166878 -3.3459194 4.0066812 ] [ -2.6073202 2.4333142 -2.2720016 ] [ 5.1222031 -0.9717125 -2.63404 ] [ -1.4188438 -5.6936403 -2.9403942 ] [ -2.228197 4.0385731 -3.9103309 ] [ 1.6488456 3.5393849 7.7500855 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.278251134125863e-10 -5.360753837761164e-09 6.419410945638889e-09 ] [ -4.177387467379581e-09 3.898599122300656e-09 -3.640147845940193e-09 ] [ 8.206674053809286e-09 -1.55685504963912e-09 -4.220197306252032e-09 ] [ -2.273238364927031e-09 -9.122217375904699e-09 -4.71103084317592e-09 ] [ -3.569965139936698e-09 6.47050740221178e-09 -6.265040747571823e-09 ] [ 2.641741871628948e-09 5.670719738792546e-09 1.241700579730108e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -10.342314 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.657021369577253e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2756777 2.0176984 4.2965467 ] [ 1.2931918 3.6639642 2.8742629 ] [ 5.0456916 2.6214812 2.43202 ] [ 3.6937435 0.7092221 2.891078 ] [ 3.4443083 4.5925653 2.4207883 ] [ 4.1718887 3.5602097 4.6348301 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2756777e-10 2.0176984e-10 4.2965467e-10 ] [ 1.2931918e-10 3.6639642e-10 2.8742629e-10 ] [ 5.0456916e-10 2.6214812e-10 2.43202e-10 ] [ 3.6937435e-10 7.092221e-11 2.891078e-10 ] [ 3.4443083e-10 4.592565300000001e-10 2.4207883e-10 ] [ 4.1718887e-10 3.5602097e-10 4.634830100000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8e-07 5.9e-06 -4.8e-06 ] [ -3.1e-06 1.65e-05 -4.2e-06 ] [ 4.6e-06 -9e-07 -8.5e-06 ] [ 1.21e-05 1e-07 1.19e-05 ] [ -1.54e-05 -4.6e-06 0.0 ] [ 1e-06 -1.7e-05 5.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.28174129664e-15 9.45284206272e-15 -7.69044777984e-15 ] [ -4.96674752448e-15 2.64359142432e-14 -6.72914180736e-15 ] [ 7.370012455680001e-15 -1.44195895872e-15 -1.36185012768e-14 ] [ 1.938633711168e-14 1.6021766208e-16 1.906590178752e-14 ] [ -2.467351996032e-14 -7.370012455680001e-15 0.0 ] [ 1.6021766208e-15 -2.72370025536e-14 8.972189076479999e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.527678 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.32759060461105e-18 } }