{ "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" [ [ 2.693951 4.828533 2.524683 ] [ 0.9874005 3.253704 2.692751 ] [ 1.797506 3.29632 4.784436 ] [ 3.246699 2.730573 2.280252 ] [ 4.077425 2.843272 4.278983 ] [ 4.93943 4.110777 2.41493 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.693951e-10 4.828533000000001e-10 2.524683e-10 ] [ 9.874005e-11 3.253704e-10 2.692751e-10 ] [ 1.797506e-10 3.29632e-10 4.784436000000001e-10 ] [ 3.246699e-10 2.730573e-10 2.280252e-10 ] [ 4.077425e-10 2.843272e-10 4.278983e-10 ] [ 4.93943e-10 4.110777e-10 2.41493e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.2238861 13.0700002 -0.5785417 ] [ -5.5536489 -1.8009059 -1.1728063 ] [ 0.3608142 0.5317433 2.8738967 ] [ -1.163757 -13.3184701 -6.1871563 ] [ 0.637032 -4.1651311 8.3352811 ] [ 9.9434458 5.6827636 -3.2706734 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.767411558342091e-09 2.094044875429132e-08 -9.269259858978875e-10 ] [ -8.897926427711638e-09 -2.885369329240783e-09 -1.879042834586951e-09 ] [ 5.780880756926553e-10 8.519466835270408e-10 4.604490103334271e-09 ] [ -1.864544257692346e-09 -2.133854141904384e-08 -9.91291717309543e-09 ] [ 1.020637777101466e-09 -6.673275670986987e-09 1.335459250621611e-08 ] [ 1.593115639095195e-08 9.104790981453243e-09 -5.240196455752447e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.8679406 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.401477241563125e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.5093813 5.5721789 2.2605124 ] [ 1.3396949 3.3931882 2.6201104 ] [ 1.729096 3.2658005 5.0853893 ] [ 3.3856268 2.151985 2.1718505 ] [ 4.0677598 2.3895934 4.5831372 ] [ 4.7108526 4.2904331 2.2550352 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5093813e-10 5.5721789e-10 2.2605124e-10 ] [ 1.3396949e-10 3.3931882e-10 2.6201104e-10 ] [ 1.729096e-10 3.2658005e-10 5.085389300000001e-10 ] [ 3.3856268e-10 2.151985e-10 2.1718505e-10 ] [ 4.0677598e-10 2.3895934e-10 4.583137200000001e-10 ] [ 4.710852600000001e-10 4.290433100000001e-10 2.2550352e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2e-07 -1.28e-05 1e-05 ] [ 1.56e-05 7.8e-06 -1e-05 ] [ -1.7e-06 -7e-06 2e-06 ] [ 2.1e-06 1.8e-05 1.73e-05 ] [ -7.3e-06 1.7e-06 -1.5e-06 ] [ -8.8e-06 -7.8e-06 -1.78e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.2043532416e-16 -2.050786074624e-14 1.6021766208e-14 ] [ 2.499395528448e-14 1.249697764224e-14 -1.6021766208e-14 ] [ -2.72370025536e-15 -1.12152363456e-14 3.2043532416e-15 ] [ 3.36457090368e-15 2.88391791744e-14 2.771765553984e-14 ] [ -1.169588933184e-14 2.72370025536e-15 -2.4032649312e-15 ] [ -1.409915426304e-14 -1.249697764224e-14 -2.851874385024e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.685082 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.352809505493091e-18 } }