{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.635409 0.2945373 0.4894103 ] [ 0.6913641 0.4672635 2.355287 ] [ 2.952385 0.4157679 2.192681 ] [ 2.385934 1.774442 0.4759126 ] [ 2.093707 2.943435 1.550224 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.35409e-11 2.945373e-11 4.894103e-11 ] [ 6.913641e-11 4.672635e-11 2.355287e-10 ] [ 2.952385e-10 4.157679e-11 2.192681e-10 ] [ 2.385934000000001e-10 1.774442e-10 4.759126e-11 ] [ 2.093707e-10 2.943435e-10 1.550224e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5881133 -0.7072218 -9.5837356 ] [ 0.5135177 3.5748409 9.6342068 ] [ 0.4128465 0.0106785 0.1049414 ] [ 4.885583 -19.2025978 -19.6746285 ] [ -6.4000605 16.3243002 19.5192159 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.422613796415365e-10 -1.133094233680094e-09 -1.535483711824866e-08 ] [ 8.227460533069881e-10 5.727526513059631e-09 1.543570089491238e-08 ] [ 6.614530102791073e-10 1.71088430452128e-11 1.681346576340211e-10 ] [ 7.827566861577925e-09 -3.076595325378551e-08 -3.152222980562537e-08 ] [ -1.025402730480556e-08 2.615441213136076e-08 3.127323137132763e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.1679081 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.88207815706295e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.823811 0.5571915 0.5435217 ] [ 0.6139447 0.733755 2.9460835 ] [ 2.8079147 0.4247132 1.9773097 ] [ 2.8895713 1.6244265 -0.1206794 ] [ 1.6235573 2.5553594 1.7172794 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.238109999999999e-11 5.571915e-11 5.435217e-11 ] [ 6.139447e-11 7.337550000000001e-11 2.9460835e-10 ] [ 2.8079147e-10 4.247132e-11 1.9773097e-10 ] [ 2.8895713e-10 1.6244265e-10 -1.206794e-11 ] [ 1.6235573e-10 2.5553594e-10 1.7172794e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.6e-05 4e-07 -6.8e-06 ] [ 1.02e-05 -1.1e-05 8e-06 ] [ -8e-06 1.5e-05 -9.4e-06 ] [ 1.72e-05 -1.12e-05 9e-06 ] [ -3.5e-06 6.8e-06 -9e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.56348259328e-14 6.408706483200001e-16 -1.089480102144e-14 ] [ 1.634220153216e-14 -1.76239428288e-14 1.28174129664e-14 ] [ -1.28174129664e-14 2.4032649312e-14 -1.506046023552e-14 ] [ 2.755743787776e-14 -1.794437815296e-14 1.44195895872e-14 ] [ -5.6076181728e-15 1.089480102144e-14 -1.44195895872e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.096417 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.899365623764767e-18 } }