{ "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" [ [ -1.7699757 -1.9469511 -1.8596493 ] [ 0.4533594 0.1179892 4.7421066 ] [ -1.8536841 -5.1241542 -5.2987467 ] [ -0.4259417 0.2553124 8.7566101 ] [ 1.5268333 1.2378899 -6.5753316 ] [ 1.4566137 1.2217289 4.6566185 ] [ 1.0217235 1.0855566 -3.321545 ] [ -0.4089285 3.1526284 -1.1000626 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.835813685924115e-09 -3.119359534260843e-09 -2.979486631347086e-09 ] [ 7.263618314999156e-10 1.890395377468954e-10 7.597692327861376e-09 ] [ -2.969929327368689e-09 -8.209800060614127e-09 -8.489528082281151e-09 ] [ -6.824338335638074e-10 4.090555582803379e-10 1.402963597968115e-08 ] [ 2.446256617118913e-09 1.98331825690445e-09 -1.053484256352746e-08 ] [ 2.333752415676985e-09 1.957425480535701e-09 7.460725292684767e-09 ] [ 1.636981504621949e-09 1.739253405075138e-09 -5.321701743935135e-09 ] [ -6.551756822788128e-10 5.051067516550111e-09 -1.762494579136462e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -28.053575 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.494678199485936e-18 } }