{ "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" [ [ 2.246807 1.041122 2.124463 ] [ 1.267764 1.326115 3.99765 ] [ 2.011294 2.700157 5.439591 ] [ 2.31677 3.176049 2.822929 ] [ 4.533635 0.1687206 2.857812 ] [ 4.258439 2.493804 2.204153 ] [ 4.092776 1.731475 4.602458 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.246807e-10 1.041122e-10 2.124463e-10 ] [ 1.267764e-10 1.326115e-10 3.99765e-10 ] [ 2.011294e-10 2.700157e-10 5.439591000000001e-10 ] [ 2.31677e-10 3.176049e-10 2.822929e-10 ] [ 4.533635000000001e-10 1.687206e-11 2.857812e-10 ] [ 4.258439e-10 2.493804e-10 2.204153e-10 ] [ 4.092776e-10 1.731475e-10 4.602458e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.1332721 -8.0331644 -8.5181461 ] [ -9.0446788 -6.0835303 2.8379365 ] [ 0.0568834 2.3594463 5.2030901 ] [ -3.8927606 12.2319838 -4.8628858 ] [ 1.9151148 -4.760426 -0.3774184 ] [ 7.1751076 5.056412 -4.4119351 ] [ 8.9236057 -0.7707215 10.1293588 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.22440854682492e-09 -1.287054819272286e-08 -1.36475745339787e-08 ] [ -1.44911729160054e-08 -9.74689001858841e-09 4.546875511614979e-09 ] [ 9.113725359161471e-11 3.780249699893063e-09 8.336269314135933e-09 ] [ -6.236890023691381e-09 1.959779847036434e-08 -7.791201938380304e-09 ] [ 3.068352158708068e-09 -7.62704324224846e-09 -6.046909367397426e-10 ] [ 1.14957896484444e-08 8.10126509153257e-09 -7.06869926970691e-09 ] [ 1.429719242577762e-08 -1.234831968447907e-09 1.622902185305475e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -0.42059238 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.738632781226295e-20 } "relaxed-configuration-positions" { "source-value" [ [ 1.9837836 0.8099929 2.1967159 ] [ 0.8264405 0.8567797 4.3330585 ] [ 2.2425746 2.7300277 4.9641553 ] [ 2.3912668 3.358034 2.5724372 ] [ 4.3686012 0.6323944 2.8431951 ] [ 4.710273 2.8927661 2.0145051 ] [ 4.2045452 1.3574479 5.1249888 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9837836e-10 8.099929000000001e-11 2.1967159e-10 ] [ 8.264405000000001e-11 8.567797000000001e-11 4.3330585e-10 ] [ 2.2425746e-10 2.7300277e-10 4.9641553e-10 ] [ 2.3912668e-10 3.358034e-10 2.5724372e-10 ] [ 4.3686012e-10 6.323944e-11 2.8431951e-10 ] [ 4.710273e-10 2.8927661e-10 2.0145051e-10 ] [ 4.2045452e-10 1.3574479e-10 5.1249888e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.01e-05 -3.2e-06 -1.36e-05 ] [ 1.08e-05 -2.85e-05 3.3e-06 ] [ -2.3e-06 2.24e-05 4.13e-05 ] [ 1.52e-05 3.48e-05 -2.63e-05 ] [ 1.66e-05 -1.6e-06 4.95e-05 ] [ -1.1e-05 4.7e-06 -2.96e-05 ] [ -1.93e-05 -2.86e-05 -2.46e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.618198387008e-14 -5.126965186560001e-15 -2.178960204288e-14 ] [ 1.730350750464e-14 -4.56620336928e-14 5.28718284864e-15 ] [ -3.68500622784e-15 3.588875630592e-14 6.616989443904001e-14 ] [ 2.435308463616e-14 5.575574640383999e-14 -4.213724512704e-14 ] [ 2.659613190528e-14 -2.56348259328e-15 7.930774272959999e-14 ] [ -1.76239428288e-14 7.53023011776e-15 -4.742442797568e-14 ] [ -3.092200878144e-14 -4.582225135488e-14 -3.941354487168e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.129296 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.783109785716296e-18 } }