{ "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" [ [ 1.662864 2.785445 0.9951273 ] [ 1.604551 1.254517 2.754062 ] [ 1.304297 2.979259 4.142484 ] [ 2.049326 4.702389 2.752286 ] [ 3.428978 2.585226 4.349041 ] [ 3.762165 3.432195 2.245626 ] [ 3.938407 4.831482 3.738967 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.662864e-10 2.785445e-10 9.951273000000001e-11 ] [ 1.604551e-10 1.254517e-10 2.754062e-10 ] [ 1.304297e-10 2.979259e-10 4.142484e-10 ] [ 2.049326e-10 4.702389e-10 2.752286e-10 ] [ 3.428978e-10 2.585226e-10 4.349041e-10 ] [ 3.762165e-10 3.432195e-10 2.245626e-10 ] [ 3.938407e-10 4.831482000000001e-10 3.738967e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1630511 -0.3165284 -1.9127402 ] [ -1.7364567 -3.4202774 -0.7474839 ] [ -5.491469 -0.687445 4.4113463 ] [ -4.4704242 4.7520206 -2.5050194 ] [ 2.8897095 -3.9284132 3.5066487 ] [ 4.586671 -1.017096 -5.3814997 ] [ 4.0589184 4.6177395 2.6287481 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.612366604157229e-10 -5.071344022992307e-10 -3.064547630104316e-09 ] [ -2.782110327771519e-09 -5.479888486930609e-09 -1.197601229004405e-09 ] [ -8.798303245647955e-09 -1.101408307085856e-09 7.067755908112583e-09 ] [ -7.162409138298543e-09 7.613576306879989e-09 -4.013483517330444e-09 ] [ 4.629825001803658e-09 -6.294011785882114e-09 5.618270564498713e-09 ] [ 7.348657043501356e-09 -1.629567432309197e-09 -8.622113004182214e-09 ] [ 6.503104166214942e-09 7.398434267844682e-09 4.211718747792421e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.086365 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.256884467505539e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9419494 3.0956946 1.0682452 ] [ 1.1751035 1.2811836 2.5012846 ] [ 1.1928816 2.7614792 4.4358461 ] [ 1.593204 4.6714001 2.9307441 ] [ 3.5009683 2.9193639 5.1987041 ] [ 4.3482127 3.2973607 1.3897045 ] [ 3.9982686 4.5440309 3.4530647 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9419494e-10 3.0956946e-10 1.0682452e-10 ] [ 1.1751035e-10 1.2811836e-10 2.5012846e-10 ] [ 1.1928816e-10 2.7614792e-10 4.4358461e-10 ] [ 1.593204e-10 4.671400099999999e-10 2.9307441e-10 ] [ 3.5009683e-10 2.9193639e-10 5.1987041e-10 ] [ 4.348212700000001e-10 3.2973607e-10 1.3897045e-10 ] [ 3.9982686e-10 4.5440309e-10 3.4530647e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.03e-05 -3.3e-06 -1.55e-05 ] [ -2.04e-05 -3.74e-05 -2.4e-06 ] [ 1.92e-05 1.35e-05 2.46e-05 ] [ 1.02e-05 8e-06 5.2e-06 ] [ -3e-05 4.7e-06 4.9e-06 ] [ 3.18e-05 1.38e-05 -4.26e-05 ] [ -5e-07 6e-07 2.58e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.650241919424e-14 -5.28718284864e-15 -2.48337376224e-14 ] [ -3.268440306432e-14 -5.992140561792e-14 -3.84522388992e-15 ] [ 3.076179111936e-14 2.16293843808e-14 3.941354487168e-14 ] [ 1.634220153216e-14 1.28174129664e-14 8.33131842816e-15 ] [ -4.8065298624e-14 7.53023011776e-15 7.850665441919999e-15 ] [ 5.094921654144e-14 2.211003736704e-14 -6.825272404608e-14 ] [ -8.010883104e-16 9.6130597248e-16 4.133615681664e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.146068 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.387973577144701e-18 } }