{ "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" [ [ 1.152391 0.2084818 1.476287 ] [ 0.2004725 1.985654 1.37487 ] [ 0.8976264 2.29727 2.845471 ] [ 1.752289 1.001076 2.997864 ] [ 1.785348 1.533822 0.3428561 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.152391e-10 2.084818e-11 1.476287e-10 ] [ 2.004725e-11 1.985654e-10 1.37487e-10 ] [ 8.976264000000001e-11 2.29727e-10 2.845471e-10 ] [ 1.752289e-10 1.001076e-10 2.997864e-10 ] [ 1.785348e-10 1.533822e-10 3.428561e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.2191485 -36.0292598 -6.7777005 ] [ -32.1961486 16.7592162 -13.7714012 ] [ -0.8024004 19.948307 14.7376808 ] [ 19.3077846 -8.6307115 19.7926617 ] [ 16.9099129 7.9524481 -13.9812407 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.157644465583389e-09 -5.772523771628928e-08 -1.085907328388447e-08 ] [ -5.158391656672265e-08 2.685122437857262e-08 -2.206421703829707e-08 ] [ -1.285587161400568e-09 3.196071109994099e-08 2.361236762257304e-08 ] [ 3.093448108556229e-08 -1.38279241861697e-08 3.171133983914358e-08 ] [ 2.709266710814433e-08 1.274122642394538e-08 -2.240041697931743e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 20.44028920076505 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.274895347985649e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8538568 -0.1824804 1.2871364 ] [ -0.3200021 1.8492797 1.0979498 ] [ 1.0223849 2.7825588 2.7916995 ] [ 2.196248 0.750799 2.9808798 ] [ 2.0356392 1.8261467 0.8796826 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.538568e-11 -1.824804e-11 1.2871364e-10 ] [ -3.200021e-11 1.8492797e-10 1.0979498e-10 ] [ 1.0223849e-10 2.7825588e-10 2.7916995e-10 ] [ 2.196248e-10 7.507990000000001e-11 2.9808798e-10 ] [ 2.0356392e-10 1.8261467e-10 8.796826e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7e-06 1e-07 -3.4e-06 ] [ 3.7e-05 9.3e-06 1.73e-05 ] [ -9e-07 -1.62e-05 -2.78e-05 ] [ -8.2e-06 2.8e-06 3.5e-06 ] [ -3.49e-05 4e-06 1.04e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.12152363456e-14 1.6021766208e-16 -5.44740051072e-15 ] [ 5.92805349696e-14 1.490024257344e-14 2.771765553984e-14 ] [ -1.44195895872e-15 -2.595526125696e-14 -4.454051005824e-14 ] [ -1.313784829056e-14 4.48609453824e-15 5.6076181728e-15 ] [ -5.591596406592e-14 6.4087064832e-15 1.666263685632e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.34072039923495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.55677736188388e-19 } }