{ "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" [ [ 2.669584 2.17361 1.86928 ] [ 2.40373 2.157546 4.053208 ] [ 2.652376 4.1548 1.079323 ] [ 1.859138 4.715654 3.12876 ] [ 4.632592 2.488435 2.820091 ] [ 5.239324 3.537857 1.028061 ] [ 3.752209 4.156911 4.495978 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.669584e-10 2.17361e-10 1.86928e-10 ] [ 2.40373e-10 2.157546e-10 4.053208e-10 ] [ 2.652376e-10 4.1548e-10 1.079323e-10 ] [ 1.859138e-10 4.715654e-10 3.12876e-10 ] [ 4.632592e-10 2.488435e-10 2.820091e-10 ] [ 5.239324e-10 3.537857e-10 1.028061e-10 ] [ 3.752209000000001e-10 4.156911e-10 4.495978e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5115621 -2.6879615 -2.0728176 ] [ -0.0868331 0.0376248 1.6148996 ] [ 0.8595041 2.0253817 -0.6480346 ] [ -0.0494088 -0.2132583 0.7754236 ] [ -0.7808211 -0.1568349 3.1289291 ] [ 0.1614558 0.9846098 -1.8856224 ] [ 0.4076652 0.0104385 -0.9127777 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.196128434599714e-10 -4.306589108391591e-09 -3.321019925263958e-09 ] [ -1.391219638777854e-10 6.02815754189232e-11 2.587354405375946e-09 ] [ 1.377077385847199e-09 3.245019234671197e-09 -1.038265894143536e-09 ] [ -7.91616248739792e-11 -3.416774652665621e-10 1.242365573372162e-09 ] [ -1.251013321754177e-09 -2.512772121757266e-10 5.01309709346265e-09 ] [ 2.586807101837772e-10 1.577518815167413e-09 -3.021100149827001e-09 ] [ 6.531516579349367e-10 1.6724320794009e-11 -1.462431102976262e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.81447106491639 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.533757601927813e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8195568 2.1060832 1.6306678 ] [ 2.2228832 2.3049766 4.0105937 ] [ 2.9938898 4.5765921 1.5361009 ] [ 1.406442 4.4398011 3.3033569 ] [ 4.9466144 2.2481877 3.1301566 ] [ 4.9278716 3.3137195 0.9899778 ] [ 3.8916953 4.3954529 3.8738473 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8195568e-10 2.1060832e-10 1.6306678e-10 ] [ 2.2228832e-10 2.3049766e-10 4.0105937e-10 ] [ 2.9938898e-10 4.5765921e-10 1.5361009e-10 ] [ 1.406442e-10 4.439801100000001e-10 3.3033569e-10 ] [ 4.9466144e-10 2.2481877e-10 3.1301566e-10 ] [ 4.9278716e-10 3.3137195e-10 9.899778e-11 ] [ 3.8916953e-10 4.395452900000001e-10 3.8738473e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.8e-06 -1.7e-06 -1.22e-05 ] [ -6.87e-05 -4.31e-05 3.55e-05 ] [ 1.66e-05 -4e-06 -5.2e-06 ] [ 3.2e-06 -5.6e-06 -1.24e-05 ] [ 3.12e-05 -8.3e-06 1.58e-05 ] [ -2.9e-06 1.32e-05 -5.59e-05 ] [ 2.64e-05 4.95e-05 3.44e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.2926244772e-15 -2.7237002778e-15 -1.95465549348e-14 ] [ -1.100695347558e-13 -6.90538129254e-14 5.6877270507e-14 ] [ 2.65961321244e-14 -6.408706535999999e-15 -8.331318496799998e-15 ] [ 5.1269652288e-15 -8.972189150399999e-15 -1.98669902616e-14 ] [ 4.998791098079999e-14 -1.32980660622e-14 2.53143908172e-14 ] [ -4.6463122386e-15 2.11487315688e-14 -8.956167384059998e-14 ] [ 4.22974631376e-14 7.930774338299999e-14 5.51148762096e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.14226006491639 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.906710516396036e-18 } }