{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.6852315 0.2393985 0.4264483 ] [ 0.2220788 0.5090328 2.375346 ] [ 0.2247887 2.304208 0.7234447 ] [ 2.310751 0.3633962 2.825111 ] [ 2.727094 1.886457 0.3477298 ] [ 2.582747 2.923748 2.275544 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.852315e-11 2.393985e-11 4.264483e-11 ] [ 2.220788e-11 5.090328e-11 2.375346e-10 ] [ 2.247887e-11 2.304208e-10 7.234447000000001e-11 ] [ 2.310751e-10 3.633962e-11 2.825111e-10 ] [ 2.727094e-10 1.886457e-10 3.477298e-11 ] [ 2.582747e-10 2.923748e-10 2.275544e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1768866 -2.1637267 -4.1185384 ] [ -3.3528594 -1.0900611 3.6503672 ] [ -1.9674331 2.7288225 -0.9044768 ] [ 2.5354759 -0.5943454 2.6071183 ] [ 1.8300145 0.3056759 -2.5206099 ] [ 0.7779155 0.8136348 1.2861396 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.834035750528013e-10 -3.466672332540735e-09 -6.59862593634704e-09 ] [ -5.371872943509515e-09 -1.746470409663531e-09 5.848532985175157e-09 ] [ -3.152175315808068e-09 4.372055611813009e-09 -1.449131583015997e-09 ] [ 4.062280209581839e-09 -9.522463045600244e-10 4.177063987919841e-09 ] [ 2.932006447625002e-09 4.897467805219988e-10 -4.038462251937026e-09 ] [ 1.246358027057942e-09 1.303586654429284e-09 2.060622798205064e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.930312 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.071664358604969e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.10368 -0.1268688 -0.0194798 ] [ 0.1092563 0.4360897 2.0587323 ] [ 0.0618167 2.8770994 1.8406365 ] [ 2.1322477 0.8207821 3.3883362 ] [ 2.8388996 1.5148139 -0.159667 ] [ 2.5067908 2.7043242 1.8650656 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.10368e-10 -1.268688e-11 -1.94798e-12 ] [ 1.092563e-11 4.360897e-11 2.0587323e-10 ] [ 6.18167e-12 2.8770994e-10 1.8406365e-10 ] [ 2.1322477e-10 8.207821e-11 3.3883362e-10 ] [ 2.8388996e-10 1.5148139e-10 -1.59667e-11 ] [ 2.5067908e-10 2.7043242e-10 1.8650656e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.56e-05 1e-06 -2.86e-05 ] [ -1e-05 -1.07e-05 3.5e-06 ] [ -7e-06 -1.9e-06 9.6e-06 ] [ 1.49e-05 2.8e-05 1e-06 ] [ 1.97e-05 -1.23e-05 7.6e-06 ] [ -2.1e-06 -4.2e-06 6.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.499395528448e-14 1.6021766208e-15 -4.582225135488e-14 ] [ -1.6021766208e-14 -1.714328984256e-14 5.6076181728e-15 ] [ -1.12152363456e-14 -3.04413557952e-15 1.538089555968e-14 ] [ 2.387243164992e-14 4.48609453824e-14 1.6021766208e-15 ] [ 3.156287942976e-14 -1.970677243584e-14 1.217654231808e-14 ] [ -3.36457090368e-15 -6.72914180736e-15 1.105501868352e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.186062 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.753510674001929e-18 } }