{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.173582 1.448006 2.849718 ] [ 1.983285 3.621531 1.348175 ] [ 2.327062 3.623818 3.682153 ] [ 3.341801 1.495458 1.660386 ] [ 3.963915 2.011825 3.715692 ] [ 4.47485 3.510245 1.32465 ] [ 4.551743 4.234559 4.054178 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.173582e-10 1.448006e-10 2.849718e-10 ] [ 1.983285e-10 3.621531e-10 1.348175e-10 ] [ 2.327062e-10 3.623818e-10 3.682153e-10 ] [ 3.341801e-10 1.495458e-10 1.660386e-10 ] [ 3.963915e-10 2.011825e-10 3.715692e-10 ] [ 4.47485e-10 3.510245e-10 1.32465e-10 ] [ 4.551743e-10 4.234559e-10 4.054178000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.7050178 3.053367 1.470829 ] [ 0.0436836 0.6391805 -1.1991383 ] [ -5.5728814 -1.9868862 -0.4376964 ] [ -1.5987922 -2.3466518 -2.3004822 ] [ 2.473144 -2.8076933 2.635454 ] [ 0.9156703 1.4162947 -0.9479483 ] [ 2.0341578 2.0323891 0.7789821 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.731739679714085e-09 4.892033262426678e-09 2.356527856409586e-09 ] [ 6.99888432090024e-11 1.024080062008437e-09 -1.921231365194482e-09 ] [ -8.928740363133207e-09 -3.18334264405705e-09 -7.012669448659176e-10 ] [ -2.561547505461454e-09 -3.759750682094041e-09 -3.685778827772914e-09 ] [ 3.962413529317296e-09 -4.498420600698351e-09 4.222462818781836e-09 ] [ 1.46706555910777e-09 2.26915427519804e-09 -1.518780616500022e-09 ] [ 3.259080097028845e-09 3.256246327216289e-09 1.248066918924251e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.857026 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.220140327393048e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5059772 1.626139 2.8967508 ] [ 2.4748227 4.6707011 1.301117 ] [ 1.8271829 3.9138539 3.427481 ] [ 3.6645262 1.2217027 2.0047914 ] [ 4.9344789 1.9211937 3.8518413 ] [ 3.6794529 2.9055683 0.3683147 ] [ 3.7297972 3.6862833 4.7846557 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5059772e-10 1.626139e-10 2.8967508e-10 ] [ 2.4748227e-10 4.6707011e-10 1.301117e-10 ] [ 1.8271829e-10 3.9138539e-10 3.427481e-10 ] [ 3.6645262e-10 1.2217027e-10 2.0047914e-10 ] [ 4.9344789e-10 1.9211937e-10 3.8518413e-10 ] [ 3.6794529e-10 2.9055683e-10 3.683147e-11 ] [ 3.7297972e-10 3.6862833e-10 4.7846557e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.14e-05 1.25e-05 -2.98e-05 ] [ -1.61e-05 -2.75e-05 3.28e-05 ] [ -2.9e-05 -1.28e-05 -2.01e-05 ] [ -4e-05 2.05e-05 -2.7e-05 ] [ 9.7e-06 -1.04e-05 1.11e-05 ] [ 2.24e-05 -1.63e-05 2.81e-05 ] [ 4.16e-05 3.4e-05 4.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.82648136276e-14 2.0027207925e-14 -4.77448636932e-14 ] [ -2.579504380739999e-14 -4.4059857435e-14 5.255139359519999e-14 ] [ -4.6463122386e-14 -2.05078609152e-14 -3.22037503434e-14 ] [ -6.408706535999999e-14 3.2844620997e-14 -4.325876911799999e-14 ] [ 1.55411133498e-14 -1.66626369936e-14 1.77841606374e-14 ] [ 3.588875660159999e-14 -2.61154791342e-14 4.50211634154e-14 ] [ 6.665054797439999e-14 5.447400555599999e-14 7.850665506599998e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.646259 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.987460048131221e-18 } }