{ "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" [ [ 0.284773 1.136187 2.117179 ] [ 0.232979 2.36751 0.607179 ] [ 0.4870779 2.766051 2.845032 ] [ 1.778488 1.070505 1.035652 ] [ 2.177899 0.7799475 2.527686 ] [ 2.528264 2.860392 0.629956 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.84773e-11 1.136187e-10 2.117179e-10 ] [ 2.32979e-11 2.36751e-10 6.07179e-11 ] [ 4.870779e-11 2.766051e-10 2.845032e-10 ] [ 1.778488e-10 1.070505e-10 1.035652e-10 ] [ 2.177899e-10 7.799475000000001e-11 2.527686e-10 ] [ 2.528264e-10 2.860392e-10 6.29956e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.4907326 -7.5199871 4.2771145 ] [ -5.0579883 5.0561772 -7.4475351 ] [ -2.4312202 8.898417 8.0863761 ] [ 5.4019153 -3.8659768 -17.3785068 ] [ 9.9895281 -5.9432589 14.9363872 ] [ 3.5884977 3.3746285 -2.4738359 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.84101831275844e-08 -1.204834752033759e-08 6.852692856384681e-09 ] [ -8.103790602539936e-09 8.100888900462005e-09 -1.193226661980739e-08 ] [ -3.8952441644567e-09 1.425683567952928e-08 1.295580273441589e-08 ] [ 8.654822401201817e-09 -6.193977645515197e-09 -2.784343729937382e-08 ] [ 1.600498837464464e-08 -9.522150460941525e-09 2.393073037105638e-08 ] [ 5.749407118734572e-09 5.406750886585372e-09 -3.963522042675727e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.41252586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.60939288367414e-20 } "relaxed-configuration-positions" { "source-value" [ [ 0.1654036 0.603515 1.3915438 ] [ 0.0854435 2.8957781 1.1424267 ] [ 0.9656185 3.1417947 3.2576263 ] [ 2.5099934 0.6415007 0.7952573 ] [ 1.7113538 0.8784921 3.2323379 ] [ 2.0516681 2.8195119 -0.0565079 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.654036e-11 6.03515e-11 1.3915438e-10 ] [ 8.544350000000001e-12 2.8957781e-10 1.1424267e-10 ] [ 9.656185000000001e-11 3.1417947e-10 3.2576263e-10 ] [ 2.5099934e-10 6.415007000000001e-11 7.952573e-11 ] [ 1.7113538e-10 8.784921000000001e-11 3.2323379e-10 ] [ 2.0516681e-10 2.8195119e-10 -5.65079e-12 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.4e-06 -5.2e-06 -1e-07 ] [ 1.1e-06 7.4e-06 1.2e-06 ] [ -2.7e-06 2e-06 1.1e-06 ] [ -1.1e-06 -7.4e-06 -2.4e-06 ] [ -1.8e-06 2.7e-06 -2.4e-06 ] [ -2.8e-06 6e-07 2.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.185610699392e-14 -8.33131842816e-15 -1.6021766208e-16 ] [ 1.76239428288e-15 1.185610699392e-14 1.92261194496e-15 ] [ -4.32587687616e-15 3.2043532416e-15 1.76239428288e-15 ] [ -1.76239428288e-15 -1.185610699392e-14 -3.84522388992e-15 ] [ -2.88391791744e-15 4.32587687616e-15 -3.84522388992e-15 ] [ -4.48609453824e-15 9.6130597248e-16 4.16565921408e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.296262 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.290513674123145e-18 } }