{ "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" [ [ 0.3527209 0.4565602 1.167471 ] [ 0.6414148 2.926013 0.4472085 ] [ 0.2560781 2.125953 2.651252 ] [ 2.793307 0.1807352 2.367537 ] [ 2.546309 2.149048 0.8335699 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.527209e-11 4.565602e-11 1.167471e-10 ] [ 6.414148e-11 2.926013000000001e-10 4.472085e-11 ] [ 2.560781e-11 2.125953e-10 2.651252e-10 ] [ 2.793307e-10 1.807352e-11 2.367537e-10 ] [ 2.546309e-10 2.149048e-10 8.335699e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.1945871 -12.0468262 -4.7632127 ] [ -6.750109 10.7224274 -9.2058303 ] [ -6.1685049 4.8587737 12.8700381 ] [ 7.0880727 -7.0846782 5.493525 ] [ 13.0251283 3.5503032 -4.39452 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.152699924792927e-08 -1.93011432924809e-08 -7.631508027837646e-09 ] [ -1.081486682765167e-08 1.717922249850533e-08 -1.474936608171225e-08 ] [ -9.883034336070242e-09 7.784613627897913e-09 2.062007415262525e-08 ] [ 1.135634436647073e-08 -1.135090577793143e-08 8.80159732078032e-09 ] [ 2.086855604518045e-08 5.688212783791428e-09 -7.040797203638015e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 42.756737 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.850384440309434e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.6654091 -1.0225147 0.3293948 ] [ -0.6961897 4.4005448 -0.8940029 ] [ -0.3092321 2.7191888 4.358037 ] [ 3.7447609 -1.1650708 3.6451475 ] [ 4.5158997 2.9061613 0.028462 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.654091e-11 -1.0225147e-10 3.293948e-11 ] [ -6.961897e-11 4.4005448e-10 -8.940029000000001e-11 ] [ -3.092321e-11 2.7191888e-10 4.358037000000001e-10 ] [ 3.7447609e-10 -1.1650708e-10 3.6451475e-10 ] [ 4.515899700000001e-10 2.9061613e-10 2.8462e-12 ] ] } "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 ] ] "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 ] ] } "relaxed-potential-energy" { "source-value" 0.0 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 0.0 } }