{ "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" [ 5.51526 0 0 ] "si-unit" "m" "si-value" [ 5.51526e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0933018 5.35906 0 ] "si-unit" "m" "si-value" [ -9.33018e-12 5.35906e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.235006 -0.443739 5.60819 ] "si-unit" "m" "si-value" [ 2.35006e-11 -4.43739e-11 5.60819e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0139599 -0.0171452 -0.258284 ] [ 1.4668 1.50235 1.27166 ] [ -0.150248 2.65293 3.01531 ] [ 1.35939 3.8116 4.44507 ] [ 2.6266 -0.11212 2.88055 ] [ 3.83653 1.13315 3.7283 ] [ 2.72617 2.6833 0.230289 ] [ 3.93014 4.1583 1.51189 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.39599e-12 -1.71452e-12 -2.58284e-11 ] [ 1.4668e-10 1.50235e-10 1.27166e-10 ] [ -1.50248e-11 2.65293e-10 3.01531e-10 ] [ 1.35939e-10 3.8116e-10 4.44507e-10 ] [ 2.6266e-10 -1.1212e-11 2.88055e-10 ] [ 3.83653e-10 1.13315e-10 3.7283e-10 ] [ 2.72617e-10 2.6833e-10 2.30289e-11 ] [ 3.930140000000001e-10 4.1583e-10 1.51189e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -36.3152658 33.6277054 30.9730519 ] [ -15.261674 -14.2272369 11.9940201 ] [ 0.8023293 -1.2025184 -2.3371245 ] [ 36.3900543 -31.7897803 -29.9632657 ] [ -22.865246 -21.3941397 -14.1902176 ] [ 23.0927898 24.3961508 20.279294 ] [ 11.0468829 12.204567 -14.1629532 ] [ 3.1101295 -1.6147478 -2.5928049 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.818347032225931e-08 5.387752384691562e-08 4.96243000378493e-08 ] [ -2.445189747852531e-08 -2.279454652756259e-08 1.921653875194634e-08 ] [ 1.285473257233576e-09 -1.926646882435065e-09 -3.744486264648933e-09 ] [ 5.830329470945122e-08 -5.093284319665351e-08 -4.800644418287365e-08 ] [ -3.663416287186196e-08 -3.427719073187177e-08 -2.273523507009556e-08 ] [ 3.699872823143353e-08 3.908694277130041e-08 3.249101100081639e-08 ] [ 1.769905766091416e-08 1.955387207548748e-08 -2.269155268547553e-08 ] [ 4.982976813614102e-09 -2.587111194962905e-09 -4.154131427300707e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.668158 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.830750991342017e-18 } }