{ "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" [ [ 2.682391 2.686577 1.562325 ] [ 1.212844 1.781832 3.455784 ] [ 1.883235 4.08794 3.099932 ] [ 4.668223 1.307552 1.415877 ] [ 3.293332 1.297731 3.803317 ] [ 4.485506 3.146522 2.925064 ] [ 3.343094 3.696236 5.003524 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.682391e-10 2.686577e-10 1.562325e-10 ] [ 1.212844e-10 1.781832e-10 3.455784e-10 ] [ 1.883235e-10 4.08794e-10 3.099932e-10 ] [ 4.668223000000001e-10 1.307552e-10 1.415877e-10 ] [ 3.293332e-10 1.297731e-10 3.803317e-10 ] [ 4.485506e-10 3.146522e-10 2.925064e-10 ] [ 3.343094e-10 3.696236e-10 5.003524e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.9546482 -0.6498684 -6.7659072 ] [ -4.19466 -0.8276382 0.3404634 ] [ -3.4777482 4.0022496 2.1058311 ] [ 0.7834295 -1.8465196 -0.4629614 ] [ 2.60383 -3.6973232 2.5594405 ] [ 6.1390463 2.6814616 1.0620551 ] [ 0.1007506 0.3376383 1.1610785 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.131691673730159e-09 -1.041203965654966e-09 -1.084017842365236e-08 ] [ -6.720586239574439e-09 -1.326022585445819e-09 5.454825042121956e-10 ] [ -5.571966904975559e-09 6.412310792555846e-09 3.373913383570517e-09 ] [ 1.255192439286303e-09 -2.958450557343026e-09 -7.417459375239276e-10 ] [ 4.17179558490822e-09 -5.923764839386108e-09 4.100675765213277e-09 ] [ 9.835836536904154e-09 4.296175120488254e-09 1.701599865240533e-09 ] [ 1.614202571814804e-10 5.409561950034822e-10 1.860252842939769e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.482942 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.160205462997723e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6825465 2.9703706 1.4295394 ] [ 1.1077686 1.6526533 3.0089333 ] [ 1.5662696 4.0680968 3.4934431 ] [ 4.467916 1.2041744 2.0649842 ] [ 3.1846777 1.0637509 4.1228184 ] [ 4.9264182 3.6196174 2.5494987 ] [ 3.6330284 3.4257267 4.596606 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6825465e-10 2.9703706e-10 1.4295394e-10 ] [ 1.1077686e-10 1.6526533e-10 3.0089333e-10 ] [ 1.5662696e-10 4.0680968e-10 3.4934431e-10 ] [ 4.467916e-10 1.2041744e-10 2.0649842e-10 ] [ 3.1846777e-10 1.0637509e-10 4.1228184e-10 ] [ 4.9264182e-10 3.6196174e-10 2.5494987e-10 ] [ 3.6330284e-10 3.4257267e-10 4.596606000000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.7e-06 -1.1e-06 -8.6e-06 ] [ -3.1e-06 3e-07 -2e-06 ] [ -5.7e-06 3.1e-06 7.4e-06 ] [ 2.3e-06 1.6e-06 3.4e-06 ] [ 2.1e-06 -1.4e-06 -2e-07 ] [ -1.2e-06 -4.3e-06 -2e-06 ] [ 2.9e-06 1.7e-06 2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.3258769118e-15 -1.7623942974e-15 -1.37787190524e-14 ] [ -4.9667475654e-15 4.806529901999999e-16 -3.204353268e-15 ] [ -9.1324068138e-15 4.9667475654e-15 1.18561070916e-14 ] [ 3.685006258199999e-15 2.5634826144e-15 5.4474005556e-15 ] [ 3.364570931399999e-15 -2.2430472876e-15 -3.204353268e-16 ] [ -1.9226119608e-15 -6.8893595262e-15 -3.204353268e-15 ] [ 4.6463122386e-15 2.7237002778e-15 3.204353268e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.735789 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.841586672135423e-18 } }