{ "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" [ [ 0.0317926 0.0463887 1.270674 ] [ 0.0111454 2.887791 2.968384 ] [ 2.5478 0.1715431 0.0845133 ] [ 1.93577 0.0052704 2.481441 ] [ 2.875434 2.93696 0.1676441 ] [ 2.282488 2.689422 2.770272 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.17926e-12 4.63887e-12 1.270674e-10 ] [ 1.11454e-12 2.887791e-10 2.968384e-10 ] [ 2.5478e-10 1.715431e-11 8.451330000000001e-12 ] [ 1.93577e-10 5.270399999999999e-13 2.481441e-10 ] [ 2.875434e-10 2.93696e-10 1.676441e-11 ] [ 2.282488e-10 2.689422e-10 2.770272e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9877597 1.3159563 -1.0791357 ] [ -0.6841621 -1.286766 -0.6805411 ] [ -2.1289278 2.5696023 1.9615808 ] [ 1.6462035 2.6169932 0.2132291 ] [ -0.8095943 -2.9350705 2.2119265 ] [ 0.988721 -2.2807153 -2.6270597 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.582565498308422e-09 2.108394417854471e-09 -1.728965989210642e-09 ] [ -1.096148521457432e-09 -2.061626401640333e-09 -1.090347039913515e-09 ] [ -3.410918348531178e-09 4.116956729813908e-09 3.142798897570161e-09 ] [ 2.637508760779133e-09 4.192885321832579e-09 3.416306788942253e-10 ] [ -1.297113059792942e-09 -4.702501335499767e-09 3.543896925227972e-09 ] [ 1.584105670693997e-09 -3.654108732360858e-09 -4.209013632785862e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.300311 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.130944733356907e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5523188 1.2598245 0.8894144 ] [ 0.1144685 2.0147599 3.1416706 ] [ 2.858792 0.4411147 0.7990654 ] [ 1.54042 0.0879157 2.7995382 ] [ 2.279798 2.5948536 -0.1439351 ] [ 2.3386327 2.3389068 2.2571749 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.523188e-11 1.2598245e-10 8.894144000000001e-11 ] [ 1.144685e-11 2.0147599e-10 3.1416706e-10 ] [ 2.858792000000001e-10 4.411147000000001e-11 7.990654e-11 ] [ 1.54042e-10 8.79157e-12 2.7995382e-10 ] [ 2.279798e-10 2.5948536e-10 -1.439351e-11 ] [ 2.3386327e-10 2.3389068e-10 2.2571749e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.1e-06 -1.27e-05 1.68e-05 ] [ 4.08e-05 -4.23e-05 4.2e-06 ] [ 3.82e-05 -5.09e-05 -1.45e-05 ] [ -6.04e-05 3.46e-05 9.5e-06 ] [ 4.6e-06 3.96e-05 -3.44e-05 ] [ -1.51e-05 3.17e-05 1.84e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.297763062848e-14 -2.034764308416e-14 2.691656722944e-14 ] [ 6.536880612864e-14 -6.777207105984e-14 6.72914180736e-15 ] [ 6.120314691456e-14 -8.155078999872e-14 -2.32315610016e-14 ] [ -9.677146789632e-14 5.543531107968001e-14 1.52206778976e-14 ] [ 7.370012455680001e-15 6.344619418368e-14 -5.511487575552001e-14 ] [ -2.419286697408e-14 5.078899887936e-14 2.948004982272e-14 ] ] } "relaxed-potential-energy" { "source-value" -23.902638 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.829624777904567e-18 } }