{ "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" [ [ 1.26846 0.3454837 2.901552 ] [ 0.267977 2.35609 2.023372 ] [ 2.685563 0.3914351 1.602855 ] [ 2.683655 1.904541 0.876934 ] [ 1.547568 2.030572 0.3165864 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.26846e-10 3.454837e-11 2.901552e-10 ] [ 2.67977e-11 2.35609e-10 2.023372e-10 ] [ 2.685563e-10 3.914351e-11 1.602855e-10 ] [ 2.683655e-10 1.904541e-10 8.769340000000001e-11 ] [ 1.547568e-10 2.030572e-10 3.165864e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.3651627 -15.9776943 28.741416 ] [ -26.3388159 12.9617992 12.685526 ] [ 23.8859242 -47.2059632 11.3571704 ] [ 119.3636097 25.4985154 21.3588737 ] [ -101.5455553 24.7233428 -74.1429861 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.461770445272821e-08 -2.559908826174942e-08 4.604882476388706e-08 ] [ -4.219943505453531e-08 2.076709164174415e-08 2.032445317975054e-08 ] [ 3.826946931944094e-08 -7.563229060138517e-08 1.819619289332178e-08 ] [ 1.912415848356361e-07 4.085312523898876e-08 3.422068808875999e-08 ] [ -1.626939146478135e-07 3.961116182218402e-08 -1.187901589257194e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 47.269189 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.573358949997653e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.035517 0.343089 3.1078791 ] [ -0.1619649 2.0235596 1.9790858 ] [ 3.1383655 0.131004 2.0758043 ] [ 3.2403876 1.6801778 0.3089481 ] [ 1.2009178 2.8502914 0.2495821 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.035517e-10 3.43089e-11 3.1078791e-10 ] [ -1.619649e-11 2.0235596e-10 1.9790858e-10 ] [ 3.1383655e-10 1.31004e-11 2.0758043e-10 ] [ 3.2403876e-10 1.6801778e-10 3.089481e-11 ] [ 1.2009178e-10 2.8502914e-10 2.495821e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.85e-05 -2.06e-05 1.15e-05 ] [ -1.36e-05 2.94e-05 2.29e-05 ] [ -2.83e-05 -7.3e-06 -2.2e-05 ] [ 2.74e-05 2.97e-05 2.7e-05 ] [ -4e-06 -3.12e-05 -3.94e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.96402674848e-14 -3.300483838848e-14 1.84250311392e-14 ] [ -2.178960204288e-14 4.710399265152e-14 3.668984461632e-14 ] [ -4.534159836864e-14 -1.169588933184e-14 -3.52478856576e-14 ] [ 4.389963940992e-14 4.758464563776e-14 4.32587687616e-14 ] [ -6.4087064832e-15 -4.998791056896e-14 -6.312575885952001e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.566682 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853186748062819e-18 } }