{ "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" [ [ 2.61879 2.030613 1.31449 ] [ 0.5326459 2.599792 1.87087 ] [ 1.791863 1.569063 3.307142 ] [ 2.645053 4.244738 2.416375 ] [ 4.072939 1.030921 3.139936 ] [ 4.500349 3.153395 1.645552 ] [ 3.28786 3.426147 4.164789 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.61879e-10 2.030613e-10 1.31449e-10 ] [ 5.326459000000001e-11 2.599792e-10 1.87087e-10 ] [ 1.791863e-10 1.569063e-10 3.307142e-10 ] [ 2.645053e-10 4.244738e-10 2.416375e-10 ] [ 4.072939e-10 1.030921e-10 3.139936e-10 ] [ 4.500349e-10 3.153395e-10 1.645552e-10 ] [ 3.28786e-10 3.426147e-10 4.164789e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.3089438 -2.5340439 -5.8511245 ] [ -4.0644997 3.5210561 -1.6638547 ] [ -1.7818474 -6.1497892 8.321283 ] [ -3.7209446 7.6712499 -7.2980278 ] [ 1.2022799 0.9824569 -0.2708359 ] [ 4.271421 0.5904823 0.9111411 ] [ 2.7846471 -4.0814121 5.8514187 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.097159154301111e-09 -4.059985892660853e-09 -9.374534879290091e-09 ] [ -6.512046394588614e-09 5.641353763945227e-09 -2.665789100748198e-09 ] [ -2.854834246113266e-09 -9.853048479088336e-09 1.333216507766049e-08 ] [ -5.961610445412008e-09 1.229069724209434e-08 -1.169272951910846e-08 ] [ 1.926264747437762e-09 1.574069476123644e-09 -4.339269470533268e-10 ] [ 6.843570863794157e-09 9.460569360562119e-10 1.459808968669995e-09 ] [ 4.46149648079852e-09 -6.539143046470231e-09 9.375006239651928e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.017236 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.886679429063611e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6558472 1.9369426 1.2423791 ] [ 0.6054646 2.9094217 2.1724616 ] [ 1.7105287 1.2394393 3.5391739 ] [ 2.4794227 4.4241195 1.9044043 ] [ 4.1487336 1.0859235 3.0738183 ] [ 4.6713856 3.2507354 1.9625856 ] [ 3.1781173 3.2080871 3.9643312 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6558472e-10 1.9369426e-10 1.2423791e-10 ] [ 6.054646e-11 2.9094217e-10 2.1724616e-10 ] [ 1.7105287e-10 1.2394393e-10 3.5391739e-10 ] [ 2.4794227e-10 4.4241195e-10 1.9044043e-10 ] [ 4.1487336e-10 1.0859235e-10 3.0738183e-10 ] [ 4.6713856e-10 3.2507354e-10 1.9625856e-10 ] [ 3.1781173e-10 3.2080871e-10 3.9643312e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.21e-05 -1.48e-05 -0.0001541 ] [ -2.62e-05 3.65e-05 0.0001447 ] [ 1.66e-05 -9.61e-05 -9.6e-05 ] [ 3.12e-05 -4.49e-05 -8.37e-05 ] [ -2.52e-05 8.25e-05 5.27e-05 ] [ 2.14e-05 -4.74e-05 3.79e-05 ] [ 4.3e-06 8.41e-05 9.85e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.540810331968e-14 -2.371221398784e-14 -2.4689541726528e-13 ] [ -4.197702746496e-14 5.84794466592e-14 2.3183495702976e-13 ] [ 2.659613190528e-14 -1.5396917325888e-13 -1.538089555968e-13 ] [ 4.998791056896e-14 -7.193773027392e-14 -1.3410218316096e-13 ] [ -4.037485084416e-14 1.32179571216e-13 8.443470791616e-14 ] [ 3.428657968511999e-14 -7.594317182591999e-14 6.072249392832e-14 ] [ 6.889359469440001e-15 1.3474305380928e-13 1.578143971488e-13 ] ] } "relaxed-potential-energy" { "source-value" -22.385491 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.586551032532881e-18 } }