{ "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" [ [ 0.5286717 0.5459164 0.2171681 ] [ 0.0530602 2.45185 0.0097729 ] [ 0.1982568 1.952172 2.366336 ] [ 2.940741 0.007829 0.5912968 ] [ 2.574768 0.9414562 2.330693 ] [ 2.158325 2.742494 1.504322 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.286717e-11 5.459164e-11 2.171681e-11 ] [ 5.30602e-12 2.45185e-10 9.7729e-13 ] [ 1.982568e-11 1.952172e-10 2.366336e-10 ] [ 2.940741e-10 7.828999999999999e-13 5.912968e-11 ] [ 2.574768e-10 9.414562e-11 2.330693e-10 ] [ 2.158325e-10 2.742494e-10 1.504322e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.1037874 -13.5292245 -8.4089798 ] [ -9.8132131 11.7097521 -11.4300493 ] [ -12.37613 2.3626648 13.7007291 ] [ 11.1181088 -11.2040044 -8.6191668 ] [ 9.0709797 -6.009994 15.1704201 ] [ 9.1040419 16.670806 -0.4129533 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.138152209141362e-08 -2.167620719145457e-08 -1.347267084033946e-08 ] [ -1.572250060374829e-08 1.87610910499837e-08 -1.831295776305141e-08 ] [ -1.982874614198151e-08 3.785406305347108e-09 2.195098785193423e-08 ] [ 1.781317398687075e-08 -1.795079390902033e-08 -1.380942753773555e-08 ] [ 1.45333116030914e-08 -9.629071877948274e-09 2.43056924119344e-08 ] [ 1.458628308696361e-08 2.670957562309236e-08 -6.616241227422087e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 114.86857 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.840397373187283e-17 } "relaxed-configuration-positions" { "source-value" [ [ -2.6895274 -3.9009845 -1.3587332 ] [ -2.8223194 5.7918835 -3.8144767 ] [ -3.7177814 3.0110445 5.8992985 ] [ 7.0661768 -2.098052 -2.6144272 ] [ 5.2225026 -1.2820399 7.1802136 ] [ 5.3947715 7.1198661 1.7277138 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.6895274e-10 -3.9009845e-10 -1.3587332e-10 ] [ -2.8223194e-10 5.7918835e-10 -3.8144767e-10 ] [ -3.7177814e-10 3.0110445e-10 5.8992985e-10 ] [ 7.0661768e-10 -2.098052e-10 -2.6144272e-10 ] [ 5.222502600000001e-10 -1.2820399e-10 7.1802136e-10 ] [ 5.3947715e-10 7.1198661e-10 1.7277138e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 -0.0 0.0 ] [ -0.0 0.0 -0.0 ] [ -0.0 0.0 -0.0 ] [ 0.0 -0.0 -0.0 ] [ 0.0 -0.0 0.0 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" -1.7763568e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.846037335159101e-34 } }