{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.18551 0 0 ] "si-unit" "m" "si-value" [ 5.18551e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.238045 5.44258 0 ] "si-unit" "m" "si-value" [ 2.38045e-11 5.44258e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0219846 -0.0831786 5.06218 ] "si-unit" "m" "si-value" [ 2.19846e-12 -8.31786e-12 5.06218e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0772431 0.350103 0.202788 ] [ 1.30878 1.27698 1.65073 ] [ 0.0902711 2.6496 2.76502 ] [ 1.60148 3.65596 4.18013 ] [ 2.76894 -0.178197 3.21948 ] [ 3.70957 1.45836 3.94737 ] [ 2.83791 2.83658 -0.151442 ] [ 4.06532 3.74454 1.70854 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.72431e-12 3.50103e-11 2.02788e-11 ] [ 1.30878e-10 1.27698e-10 1.65073e-10 ] [ 9.02711e-12 2.6496e-10 2.76502e-10 ] [ 1.60148e-10 3.65596e-10 4.18013e-10 ] [ 2.76894e-10 -1.78197e-11 3.21948e-10 ] [ 3.70957e-10 1.45836e-10 3.94737e-10 ] [ 2.83791e-10 2.83658e-10 -1.51442e-11 ] [ 4.06532e-10 3.74454e-10 1.70854e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2725284 -3.5497656 -0.2037272 ] [ 3.2310772 0.5155754 -0.2679794 ] [ 2.734457 -2.6471606 2.3212533 ] [ -12.015897 10.4858523 -4.4417009 ] [ -3.1675112 -0.8557709 -4.9736728 ] [ 8.7566063 -5.7441081 -2.1579343 ] [ 3.246577 -3.79293 14.0262599 ] [ -1.5127809 5.5883074 -4.3024987 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.038815251784031e-09 -5.687351453640085e-09 -3.264069568610457e-10 ] [ 5.176756349839926e-09 8.260428521396083e-10 -4.293503295360115e-10 ] [ 4.381083075982906e-09 -4.2412188248229e-09 3.719057768214849e-09 ] [ -1.925158925134086e-08 1.680018740422191e-08 -7.116389338566318e-09 ] [ -5.074912390762153e-09 -1.371096128740975e-09 -7.968702279668874e-09 ] [ 1.402962989140999e-08 -9.20307570516791e-09 -3.457391884682413e-09 ] [ 5.201589767027001e-09 -6.076943770330945e-09 2.247254568904455e-08 ] [ -2.423742190372783e-09 8.953455466123634e-09 -6.893362828162393e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.636776 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.184852369028654e-18 } }