{ "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" [ 5.52526 0 0 ] "si-unit" "m" "si-value" [ 5.52526e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.163004 5.51064 0 ] "si-unit" "m" "si-value" [ 1.63004e-11 5.510640000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0929221 -0.0543858 5.47616 ] "si-unit" "m" "si-value" [ 9.29221e-12 -5.43858e-12 5.47616e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0515746 -0.0381365 -0.00729456 ] [ 1.44408 1.32704 1.45073 ] [ 0.0791767 2.70101 2.71983 ] [ 1.48556 4.06547 4.00394 ] [ 2.80111 0.011527 2.65388 ] [ 4.15958 1.27318 3.97985 ] [ 2.73428 2.80936 0.100172 ] [ 4.13679 4.02299 1.21489 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.15746e-12 -3.81365e-12 -7.29456e-13 ] [ 1.44408e-10 1.32704e-10 1.45073e-10 ] [ 7.917670000000001e-12 2.70101e-10 2.71983e-10 ] [ 1.48556e-10 4.06547e-10 4.00394e-10 ] [ 2.80111e-10 1.1527e-12 2.65388e-10 ] [ 4.15958e-10 1.27318e-10 3.97985e-10 ] [ 2.73428e-10 2.80936e-10 1.00172e-11 ] [ 4.136790000000001e-10 4.02299e-10 1.21489e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4170429 0.5011785 0.04748339999999999 ] [ -0.845933 0.4782204 -1.7270186999999995 ] [ -0.9232811 0.2350729 -0.2963508999999999 ] [ 1.1063808 0.0435578 0.25222579999999994 ] [ -0.2735902 -1.8587069 0.6375644999999999 ] [ 0.8559946 0.8053102 1.7417976999999996 ] [ -1.1300695 -2.0260533 -2.6725000999999997 ] [ 2.6275413 1.8214204 2.0167982999999996 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.270353005050632e-09 8.029764755476128e-10 7.60767933560947e-11 ] [ -1.355334075363206e-09 7.661935444696243e-10 -2.766988984824408e-09 ] [ -1.479259392846507e-09 3.766283045636564e-10 -4.748064835330386e-10 ] [ 1.772617451462001e-09 6.978728881348224e-11 4.041102799225765e-10 ] [ -4.383398221199962e-10 -2.977976740099644e-09 1.021490936152041e-09 ] [ 1.371454535651048e-09 1.290249174931772e-09 2.790667553103211e-09 ] [ -1.810570932779146e-09 -3.246095229754689e-09 -4.281817179305662e-09 ] [ 4.209785241046439e-09 2.918237181528185e-09 3.231267085129184e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.998073 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.767527095445172e-18 } }