{ "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" [ [ 0.1724043 0.1217148 2.355607 ] [ 0.0803944 1.628444 0.6781111 ] [ 0.0194903 2.198586 2.964695 ] [ 2.614645 0.684385 2.185781 ] [ 2.191382 2.601245 1.67848 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.724043e-11 1.217148e-11 2.355607e-10 ] [ 8.03944e-12 1.628444e-10 6.781111e-11 ] [ 1.94903e-12 2.198586e-10 2.964695e-10 ] [ 2.614645e-10 6.84385e-11 2.185781e-10 ] [ 2.191382e-10 2.601245e-10 1.67848e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.4194041 -15.2943414 4.020681 ] [ -7.4589011 2.0604511 -15.0068959 ] [ -8.0595554 9.5142873 11.6930449 ] [ 12.8534579 -9.6517762 2.6070621 ] [ 9.0844028 13.3713792 -3.313892 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.028501916848767e-08 -2.450423622161354e-08 6.441841097894764e-09 ] [ -1.19504769592794e-08 3.301206580721642e-09 -2.404369776175938e-08 ] [ -1.291283123592239e-08 1.524356867563436e-08 1.873432316474467e-08 ] [ 2.059350974381707e-08 -1.546385017683386e-08 4.176973945593751e-09 ] [ 1.455481778009006e-08 2.142331114209141e-08 -5.309440286256154e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 81.682177 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.308692743254475e-17 } "relaxed-configuration-positions" { "source-value" [ [ -2.6797804 -4.7432633 3.6242132 ] [ -2.115262 2.0374253 -3.7109902 ] [ -2.3577597 4.8330122 6.4897118 ] [ 6.9728384 -2.2176099 2.9548693 ] [ 5.2582798 7.3248105 0.50487 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.6797804e-10 -4.743263299999999e-10 3.6242132e-10 ] [ -2.115262e-10 2.0374253e-10 -3.7109902e-10 ] [ -2.3577597e-10 4.8330122e-10 6.489711800000001e-10 ] [ 6.9728384e-10 -2.2176099e-10 2.9548693e-10 ] [ 5.2582798e-10 7.324810500000001e-10 5.0487e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 -0.0 0.0 ] [ -0.0 0.0 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 0.0 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 0.0 } }