{ "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" [ [ 2.912622 1.78272 1.2568 ] [ 2.727936 0.232034 3.207427 ] [ 3.003232 2.746828 4.7469 ] [ 4.479923 1.355966 2.983258 ] [ 4.230826 3.711883 2.275883 ] [ 5.441026 3.401037 4.285306 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.912622e-10 1.78272e-10 1.2568e-10 ] [ 2.727936e-10 2.32034e-11 3.207427e-10 ] [ 3.003232e-10 2.746828e-10 4.7469e-10 ] [ 4.479923e-10 1.355966e-10 2.983258e-10 ] [ 4.230826000000001e-10 3.711883e-10 2.275883e-10 ] [ 5.441026e-10 3.401037e-10 4.285306000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -146.5934695 -114.4728731 47.2776285 ] [ -173.3762106 27.5261102 -165.2009244 ] [ -14.9737111 -2.1894877 11.2033151 ] [ 317.5231366 51.747224 110.3897832 ] [ -8.4328361 21.3801552 -26.5907029 ] [ 25.8530907 16.0088714 22.9209004 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.348686315298917e-07 -1.834057625076671e-07 7.574711169363246e-08 ] [ -2.777793135147831e-07 4.410169058734906e-08 -2.646810609888804e-07 ] [ -2.399053004868643e-08 -3.507946033370401e-09 1.794968967655937e-08 ] [ 5.087281502149102e-07 8.290819316716402e-08 1.768639312753657e-07 ] [ -1.351089295777169e-08 3.42547850927336e-08 -4.260300286801603e-08 ] [ 4.142121783622269e-08 2.564903969379087e-08 3.672333105112125e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 50.372269 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.070527239336255e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7257327 1.8501273 1.0174896 ] [ 2.5075098 0.4148138 3.4698359 ] [ 2.7121498 2.4404435 5.3790701 ] [ 5.1959404 1.1057339 2.8072209 ] [ 4.5316798 3.955675 1.6688849 ] [ 5.1225525 3.4636745 4.4130725 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7257327e-10 1.8501273e-10 1.0174896e-10 ] [ 2.5075098e-10 4.148138e-11 3.4698359e-10 ] [ 2.7121498e-10 2.4404435e-10 5.3790701e-10 ] [ 5.1959404e-10 1.1057339e-10 2.8072209e-10 ] [ 4.5316798e-10 3.955675e-10 1.6688849e-10 ] [ 5.122552500000001e-10 3.4636745e-10 4.413072500000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.8e-06 6.7e-06 6.8e-06 ] [ 1.26e-05 5.41e-05 4e-06 ] [ -3.28e-05 -4.77e-05 -1.21e-05 ] [ 3.2e-06 -9.6e-06 -2e-05 ] [ -6.1e-06 -5.75e-05 3.41e-05 ] [ 2.69e-05 5.39e-05 -1.27e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.088271209199999e-15 1.07345834478e-14 1.08948011112e-14 ] [ 2.01874255884e-14 8.66777558994e-14 6.408706535999999e-15 ] [ -5.255139359519999e-14 -7.64238254418e-14 -1.93863372714e-14 ] [ 5.1269652288e-15 -1.53808956864e-14 -3.204353268e-14 ] [ -9.773277467399999e-15 -9.212515645499998e-14 5.46342232194e-14 ] [ 4.309855145459999e-14 8.635732057259999e-14 -2.03476432518e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.539142 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.489645022480803e-18 } }