{ "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" [ 5.42631 0 0 ] "si-unit" "m" "si-value" [ 5.42631e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0419811 5.40206 0 ] "si-unit" "m" "si-value" [ -4.19811e-12 5.40206e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.291495 -0.184222 5.7849 ] "si-unit" "m" "si-value" [ -2.91495e-11 -1.84222e-11 5.7849e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.101951 0.0451697 -0.178669 ] [ 1.35762 1.34832 0.905447 ] [ 0.453616 2.71025 3.0057 ] [ 1.36179 4.05856 4.06079 ] [ 2.63302 -0.145655 3.08939 ] [ 4.07266 1.35506 3.53695 ] [ 2.85903 2.69843 0.171649 ] [ 4.20927 3.69056 1.74197 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.01951e-11 4.51697e-12 -1.78669e-11 ] [ 1.35762e-10 1.34832e-10 9.05447e-11 ] [ 4.53616e-11 2.71025e-10 3.0057e-10 ] [ 1.36179e-10 4.05856e-10 4.06079e-10 ] [ 2.63302e-10 -1.45655e-11 3.08939e-10 ] [ 4.07266e-10 1.35506e-10 3.53695e-10 ] [ 2.85903e-10 2.69843e-10 1.71649e-11 ] [ 4.20927e-10 3.69056e-10 1.74197e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.7725558 -1.9362013 -2.1373587 ] [ 0.8746917 0.256938 5.0661523 ] [ -3.9962844 -7.2365694 -6.8168051 ] [ -0.4879047 1.2005992 10.6654321 ] [ 3.3241779 2.7842663 -7.6370371 ] [ 0.8675755 1.4540349 5.1718623 ] [ 1.507379 0.8461485 -4.0824214 ] [ -0.3170793 2.6307839 -0.2298243 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.839947485221177e-09 -3.102136481580424e-09 -3.424426167616616e-09 ] [ 1.401410603693738e-09 4.11660059986692e-10 8.116870839345358e-09 ] [ -6.402753488498709e-09 -1.15942624029994e-08 -1.092172584975203e-08 ] [ -7.817095099587798e-10 1.923571985039093e-09 1.708790610213355e-08 ] [ 5.325920158639189e-09 4.460886408693634e-09 -1.223588239461112e-08 ] [ 1.390009194330867e-09 2.329620741800526e-09 8.286236931325497e-09 ] [ 2.415087412382286e-09 1.355679355594149e-09 -6.540760177221568e-09 ] [ -5.080170455850762e-10 4.214980493683392e-09 -3.682191233854061e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -28.100361 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.502174180116487e-18 } }