{ "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" [ [ 2.742286 2.30018 2.898395 ] [ 1.359684 3.93311 2.87757 ] [ 2.145194 3.5026 4.929711 ] [ 3.276834 4.602113 2.280609 ] [ 3.311324 5.492688 4.465054 ] [ 4.684796 3.351118 3.565163 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.742286e-10 2.30018e-10 2.898395e-10 ] [ 1.359684e-10 3.93311e-10 2.87757e-10 ] [ 2.145194e-10 3.5026e-10 4.929711e-10 ] [ 3.276834e-10 4.602113e-10 2.280609e-10 ] [ 3.311324e-10 5.492688e-10 4.465054e-10 ] [ 4.684796000000001e-10 3.351118e-10 3.565163e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.7282819 -5.3319878 -0.64737 ] [ -10.1158388 1.0464889 -2.2384596 ] [ -0.2333501 -0.7718436 2.9907982 ] [ 3.2193526 3.2420592 -3.5998199 ] [ 2.725539 1.5638487 1.7266961 ] [ 2.6760154 0.2514346 1.7681552 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.769012854331804e-09 -8.542786195550826e-09 -1.037201079007296e-09 ] [ -1.620736042514153e-08 1.676660049506709e-09 -3.58640763772532e-09 ] [ -3.738680746813421e-10 -1.236629770834107e-09 4.791786953570723e-09 ] [ 5.157971469831695e-09 5.194351453489551e-09 -5.767547282870594e-09 ] [ 4.366794864878611e-09 2.505561825608473e-09 2.766472122646539e-09 ] [ 4.28744931078076e-09 4.028426377801997e-10 2.832896923385948e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.71161 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.517277421712749e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8930529 2.3533552 3.1948822 ] [ 0.980535 3.7905728 2.6380353 ] [ 1.7620956 3.7152201 4.9114629 ] [ 3.1887912 4.7243447 2.2528434 ] [ 3.6823546 5.0751146 4.6431334 ] [ 5.0132886 3.5232016 3.3761448 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8930529e-10 2.3533552e-10 3.1948822e-10 ] [ 9.80535e-11 3.7905728e-10 2.6380353e-10 ] [ 1.7620956e-10 3.7152201e-10 4.9114629e-10 ] [ 3.1887912e-10 4.724344699999999e-10 2.2528434e-10 ] [ 3.6823546e-10 5.0751146e-10 4.6431334e-10 ] [ 5.013288600000001e-10 3.5232016e-10 3.3761448e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.04e-05 0.0001007 5.56e-05 ] [ 1.04e-05 1.11e-05 -3.56e-05 ] [ 2.11e-05 -3.1e-05 7.5e-06 ] [ 2.1e-05 -4.88e-05 3.51e-05 ] [ 3.26e-05 -0.0001043 -7.77e-05 ] [ -9.55e-05 7.24e-05 1.51e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.666263685632e-14 1.6133918571456e-13 8.908102011648e-14 ] [ 1.666263685632e-14 1.778416049088e-14 -5.703748770048e-14 ] [ 3.380592669888e-14 -4.96674752448e-14 1.2016324656e-14 ] [ 3.36457090368e-14 -7.818621909504e-14 5.623639939008e-14 ] [ 5.223095783807999e-14 -1.6710702154944e-13 -1.2448912343616e-13 ] [ -1.530078672864e-13 1.1599758734592e-13 2.419286697408e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.237465 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.921964004565827e-18 } }