{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 3.06935e-12 1.0510015e-10 1.685929e-10 ] [ 6.358283000000001e-11 2.3398457e-10 -1.444995e-11 ] [ 1.1327588e-10 2.2637345e-10 3.3628543e-10 ] [ 2.5796694e-10 8.423686000000001e-11 -3.699467e-11 ] [ 2.5032522e-10 8.593797e-11 2.0090592e-10 ] [ 2.8735802e-10 3.026198e-10 3.224371e-11 ] ] "source-value" [ [ 0.0306935 1.0510015 1.685929 ] [ 0.6358283 2.3398457 -0.1444995 ] [ 1.1327588 2.2637345 3.3628543 ] [ 2.5796694 0.8423686 -0.3699467 ] [ 2.5032522 0.8593797 2.0090592 ] [ 2.8735802 3.026198 0.3224371 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 4.277186728653888e-10 -1.812494345812416e-10 2.672494690559232e-10 ] [ 4.398417024843341e-10 -3.170789243570861e-10 -6.151765418522304e-10 ] [ 8.399362869245376e-11 1.54099270000489e-10 4.228426085376461e-10 ] [ -5.331034422751296e-10 -6.141085309168051e-10 -1.099911874122029e-10 ] [ -5.792453278658592e-10 -1.93126369871232e-10 -3.030988118169715e-10 ] [ 1.607946058811501e-10 1.151463989725876e-09 3.381744634878355e-10 ] ] "source-value" [ [ 0.266961 -0.113127 0.166804 ] [ 0.2745276 -0.1979051 -0.383963 ] [ 0.0524247 0.0961812 0.2639176 ] [ -0.332737 -0.3832964 -0.0686511 ] [ -0.3615365 -0.12054 -0.1891794 ] [ 0.1003601 0.7186873 0.2110719 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.701574196226752e-18 "source-value" -16.8619 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -5.662353733240547e-08 -3.706400412692866e-08 -2.710170514667992e-09 ] [ -8.181104756900276e-09 2.725416923522123e-08 -2.648954101731012e-08 ] [ -2.86293789524361e-09 3.421727144711613e-08 3.478857254242542e-08 ] [ 8.856661567754623e-09 -1.238595897896088e-08 -4.511581643488362e-08 ] [ 5.464704771247652e-08 -2.322991652751641e-08 3.934081662746138e-08 ] [ 4.163870704318202e-09 1.120843895106859e-08 1.86138796974937e-10 ] ] "source-value" [ [ -35.3416325 -23.133532 -1.6915554 ] [ -5.106244 17.0107146 -16.5334712 ] [ -1.7869053 21.3567412 21.7133193 ] [ 5.5278934 -7.7307076 -28.159078 ] [ 34.1080047 -14.4989736 24.5546066 ] [ 2.5988837 6.9957574 0.1161787 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 1.173242456641241e-18 "source-value" 7.3228035 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 5.419945000000001e-11 1.059703e-10 1.497036e-10 ] [ 5.287309e-11 2.297187e-10 1.799033e-11 ] [ 1.173246e-10 2.181689e-10 2.79912e-10 ] [ 2.288869e-10 1.000101e-10 1.162968e-11 ] [ 2.25753e-10 9.328521e-11 1.885741e-10 ] [ 2.965412e-10 2.910996e-10 3.877363e-11 ] ] "source-value" [ [ 0.5419945 1.059703 1.497036 ] [ 0.5287309 2.297187 0.1799033 ] [ 1.173246 2.181689 2.79912 ] [ 2.288869 1.000101 0.1162968 ] [ 2.25753 0.9328521 1.885741 ] [ 2.965412 2.910996 0.3877363 ] ] } "instance-id" 1 }