{ "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" [ [ 1.086446 2.17872 1.239282 ] [ 2.929314 1.55844 2.269162 ] [ 0.8330856 2.151385 3.328528 ] [ 0.5041522 4.058533 2.531522 ] [ 2.750614 3.605463 1.493085 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.086446e-10 2.17872e-10 1.239282e-10 ] [ 2.929314e-10 1.55844e-10 2.269162e-10 ] [ 8.330856e-11 2.151385e-10 3.328528e-10 ] [ 5.041522000000001e-11 4.058533e-10 2.531522e-10 ] [ 2.750614e-10 3.605463e-10 1.493085e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.0994707 -12.4290747 -23.9971462 ] [ 17.4253207 -13.2306051 4.5402641 ] [ -16.5553932 -13.5692314 27.5387332 ] [ -10.3989045 18.6774593 5.4651884 ] [ 22.6284476 20.551452 -13.5470396 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.098766570039461e-08 -1.991357290251677e-08 -3.844766660755956e-08 ] [ 2.791844143548229e-08 -2.119776617025725e-08 7.274304993277553e-09 ] [ -2.65246639331913e-08 -2.174030531130525e-08 4.412191449948877e-08 ] [ -1.666088167183192e-08 2.992458862640354e-08 8.756197082747357e-09 ] [ 3.625476970971787e-08 3.29270559178934e-08 -2.170475012817179e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 16.19402 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.594568024076762e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2644386 0.778609 0.1658045 ] [ 2.3459993 1.7282054 2.0256262 ] [ 0.6932824 2.285303 3.729046 ] [ 1.0732679 4.6587426 3.321938 ] [ 2.7266237 4.101681 1.6191642 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2644386e-10 7.78609e-11 1.658045e-11 ] [ 2.3459993e-10 1.7282054e-10 2.0256262e-10 ] [ 6.932824e-11 2.285303e-10 3.729046e-10 ] [ 1.0732679e-10 4.6587426e-10 3.321938e-10 ] [ 2.7266237e-10 4.101681e-10 1.6191642e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.55e-05 2.62e-05 3.61e-05 ] [ 1.1e-06 -1.37e-05 -1.35e-05 ] [ -1.04e-05 2.9e-06 -1.92e-05 ] [ 1.38e-05 -6.9e-06 7.1e-06 ] [ -2.01e-05 -8.5e-06 -1.06e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.48337376224e-14 4.197702746496e-14 5.783857601088001e-14 ] [ 1.76239428288e-15 -2.194981970496e-14 -2.16293843808e-14 ] [ -1.666263685632e-14 4.646312200320001e-15 -3.076179111936e-14 ] [ 2.211003736704e-14 -1.105501868352e-14 1.137545400768e-14 ] [ -3.220375007808e-14 -1.36185012768e-14 -1.698307218048e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.7587726 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.563527730742363e-18 } }