{ "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" [ [ 2.316837 2.864638 1.901515 ] [ 3.52699 0.8132212 1.584521 ] [ 4.498469 2.850966 1.401087 ] [ 3.329161 3.035367 4.525662 ] [ 4.789001 1.444676 3.549999 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.316837e-10 2.864638e-10 1.901515e-10 ] [ 3.52699e-10 8.132212e-11 1.584521e-10 ] [ 4.498469e-10 2.850966e-10 1.401087e-10 ] [ 3.329161e-10 3.035367e-10 4.525662e-10 ] [ 4.789001e-10 1.444676e-10 3.549999e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.6833593 2.9408746 1.6680073 ] [ -2.5945354 -8.6236614 -0.4370152 ] [ 9.9236178 5.9726041 -2.2886816 ] [ -1.5546011 0.7444052 0.3567052 ] [ 2.9088779 -1.0342224 0.7009843 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.391227526046625e-08 4.711800528824551e-09 2.672442299383732e-09 ] [ -4.156903959717976e-09 -1.38166286807754e-08 -7.001755363742361e-10 ] [ 1.589938843291473e-08 9.569166654314226e-09 -3.666872151975137e-09 ] [ -2.490745537089963e-09 1.192668607841948e-09 5.715047319577882e-10 ] [ 4.6605361641418e-09 -1.657006949987666e-09 1.123100657007853e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.1960833 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.473374966618931e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3618076 3.3959687 2.1833502 ] [ 3.3813725 0.290887 1.2397677 ] [ 4.5007015 2.5123301 1.3848139 ] [ 3.0676532 2.9146931 4.4914336 ] [ 5.1489232 1.8949893 3.6634185 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3618076e-10 3.3959687e-10 2.1833502e-10 ] [ 3.3813725e-10 2.90887e-11 1.2397677e-10 ] [ 4.5007015e-10 2.5123301e-10 1.3848139e-10 ] [ 3.0676532e-10 2.9146931e-10 4.4914336e-10 ] [ 5.1489232e-10 1.8949893e-10 3.6634185e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.05e-05 -3.04e-05 -8e-06 ] [ 1.04e-05 1.29e-05 4.9e-06 ] [ -2.48e-05 2.28e-05 2.54e-05 ] [ 1.47e-05 2.32e-05 -1.47e-05 ] [ -1.08e-05 -2.86e-05 -7.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.68228545184e-14 -4.870616927232e-14 -1.28174129664e-14 ] [ 1.666263685632e-14 2.066807840832e-14 7.850665441919999e-15 ] [ -3.973398019584e-14 3.652962695424e-14 4.069528616832e-14 ] [ 2.355199632576e-14 3.717049760256e-14 -2.355199632576e-14 ] [ -1.730350750464e-14 -4.582225135488e-14 -1.217654231808e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.027456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.927010881090069e-18 } }