{ "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" [ [ 2.448876 1.489587 3.211478 ] [ 1.818052 3.686595 2.502768 ] [ 2.645526 3.343853 4.556562 ] [ 4.834539 1.578647 2.504909 ] [ 4.649923 2.062861 4.836234 ] [ 4.865091 3.729921 2.57452 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.448876e-10 1.489587e-10 3.211478e-10 ] [ 1.818052e-10 3.686595e-10 2.502768e-10 ] [ 2.645526e-10 3.343853e-10 4.556562e-10 ] [ 4.834539e-10 1.578647e-10 2.504909e-10 ] [ 4.649923e-10 2.062861e-10 4.836234000000001e-10 ] [ 4.865090999999999e-10 3.729921e-10 2.57452e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5503633 -1.650756 -1.2541806 ] [ 0.1552767 0.2226245 -1.6213824 ] [ 0.683504 0.9038235 2.5342812 ] [ -1.4417074 -2.2920686 -0.4707329 ] [ 0.1517286 0.1357316 1.0340255 ] [ -0.0991653 2.6806449 -0.2220108 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.817792194711321e-10 -2.644802691635303e-09 -2.0094188521361e-09 ] [ 2.487807005446278e-10 3.56683772055933e-10 -2.597740996058841e-09 ] [ 1.095094138045536e-09 1.448084892960099e-09 4.060366122625481e-09 ] [ -2.309869909344891e-09 -3.672298754445092e-09 -7.541972532350586e-10 ] [ 2.430960176295324e-10 2.174659980154344e-10 1.656691495060167e-09 ] [ -1.588803265636002e-10 4.294866622831266e-09 -3.557005162556472e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -13.29352805564262 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.129858003417406e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.318892 1.354059 3.2263135 ] [ 2.321704 3.5929585 2.3535155 ] [ 2.6739874 3.2819469 4.7181455 ] [ 4.6062326 1.5746451 2.4716879 ] [ 4.7215284 2.1320395 4.8307835 ] [ 4.6196626 3.9558151 2.5860251 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.318892e-10 1.354059e-10 3.2263135e-10 ] [ 2.321704e-10 3.5929585e-10 2.3535155e-10 ] [ 2.6739874e-10 3.2819469e-10 4.718145500000001e-10 ] [ 4.606232600000001e-10 1.5746451e-10 2.4716879e-10 ] [ 4.721528400000001e-10 2.1320395e-10 4.8307835e-10 ] [ 4.6196626e-10 3.955815100000001e-10 2.5860251e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0193633 -0.0194099 -0.0113318 ] [ -0.0293083 0.0048086 -0.0058022 ] [ -0.0382921 0.0133958 0.0446194 ] [ 0.0181246 -0.0352757 -0.0202049 ] [ 0.0193519 0.0034189 0.0125608 ] [ 0.0494873 0.0330623 -0.0198414 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.10234268171322e-11 -3.10980882482766e-11 -1.81555451811612e-11 ] [ -4.69570734422622e-11 7.704226562252398e-12 -9.2961492657948e-12 ] [ -6.13507078867914e-11 2.14624377537372e-11 7.14881601030996e-11 ] [ 2.90388106205964e-11 -5.65179022879938e-11 -3.23718186723066e-11 ] [ 3.100516200350459e-11 5.477681693982599e-12 2.01246202643472e-11 ] [ 7.928739573974818e-11 5.29716445262982e-11 -3.17894274658476e-11 ] ] } "relaxed-potential-energy" { "source-value" -14.74353205564262 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.362174256218059e-18 } }