{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0409622 2.87289 0.6143003 ] [ 0.4467191 2.12103 2.019138 ] [ 1.9155 0.4332474 1.113336 ] [ 2.832667 2.287938 0.2396185 ] [ 2.613397 2.701371 2.225579 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.09622e-12 2.87289e-10 6.143003e-11 ] [ 4.467191e-11 2.12103e-10 2.019138e-10 ] [ 1.9155e-10 4.332474e-11 1.113336e-10 ] [ 2.832667e-10 2.287938e-10 2.396185e-11 ] [ 2.613397e-10 2.701371e-10 2.225579e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.0260488 9.7143745 -18.7387301 ] [ 5.0499413 -11.6198081 18.7159157 ] [ -1.2049407 2.0754128 1.8149342 ] [ 0.8774178 0.0483755 -6.1290742 ] [ -0.6963695 -0.2183546 4.3369544 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.450441314703738e-09 1.556414383782543e-08 -3.002275551705248e-08 ] [ 8.090897953931584e-09 -1.861698502938393e-08 2.998620281845375e-08 ] [ -1.930527834895604e-09 3.325177894064515e-09 2.907845167487483e-09 ] [ 1.405778297415685e-09 7.7506095758067e-11 -9.819859471292241e-09 ] [ -1.115706941530263e-09 -3.498426380464164e-10 6.948567002403489e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.067210046368849 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.516388901862227e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.3084639 2.9933748 0.2685924 ] [ 0.3849467 1.9087829 2.3301444 ] [ 1.9742833 0.5375981 1.2869368 ] [ 2.5476063 2.407344 -0.0052554 ] [ 2.6339451 2.5693765 2.3315536 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.084639000000001e-11 2.9933748e-10 2.685924e-11 ] [ 3.849467e-11 1.9087829e-10 2.3301444e-10 ] [ 1.9742833e-10 5.375981e-11 1.2869368e-10 ] [ 2.5476063e-10 2.407344e-10 -5.255400000000001e-13 ] [ 2.6339451e-10 2.5693765e-10 2.3315536e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.04e-05 2.59e-05 3.52e-05 ] [ -7.8e-06 -1.76e-05 -1.27e-05 ] [ 8.6e-06 -3.31e-05 2.4e-05 ] [ -1.5e-06 2.1e-06 -1.11e-05 ] [ -2.96e-05 2.27e-05 -3.54e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.870616967359999e-14 4.149637482059999e-14 5.63966175168e-14 ] [ -1.24969777452e-14 -2.81983087584e-14 -2.03476432518e-14 ] [ 1.37787190524e-14 -5.303204658539999e-14 3.8452239216e-14 ] [ -2.403264951e-15 3.364570931399999e-15 -1.77841606374e-14 ] [ -4.74244283664e-14 3.636940959179999e-14 -5.671705284359999e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.68810404636885 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.872640719885302e-18 } }