{ "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" [ 5.4419 0 0 ] "si-unit" "m" "si-value" [ 5.441900000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.361794 5.44502 0 ] "si-unit" "m" "si-value" [ 3.61794e-11 5.44502e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0366443 0.298499 5.53333 ] "si-unit" "m" "si-value" [ 3.66443e-12 2.98499e-11 5.53333e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.128377 -0.150066 -0.170326 ] [ 1.39649 1.37402 1.31098 ] [ -0.0542726 2.97617 3.14736 ] [ 1.41657 4.24499 4.02908 ] [ 2.7363 -0.234712 2.6251 ] [ 4.24505 1.08558 3.99518 ] [ 2.94651 2.56191 -0.00354123 ] [ 4.33312 3.8007 1.43779 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.28377e-11 -1.50066e-11 -1.70326e-11 ] [ 1.39649e-10 1.37402e-10 1.31098e-10 ] [ -5.42726e-12 2.97617e-10 3.14736e-10 ] [ 1.41657e-10 4.24499e-10 4.02908e-10 ] [ 2.7363e-10 -2.34712e-11 2.6251e-10 ] [ 4.24505e-10 1.08558e-10 3.99518e-10 ] [ 2.94651e-10 2.56191e-10 -3.54123e-13 ] [ 4.33312e-10 3.8007e-10 1.43779e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.183190999999999 0.8489172999999999 11.258253699999997 ] [ -2.7226695999999997 0.7217290999999999 1.1220452999999997 ] [ 1.9241750999999998 -5.781691799999999 0.46526759999999995 ] [ 6.976401899999999 -0.7840612999999999 0.7040301999999999 ] [ -3.4726577999999995 3.8150742999999996 -0.7127122999999999 ] [ -7.031301999999999 3.6947979999999996 -4.698061199999999 ] [ -0.6468999999999999 -1.2526178999999997 -1.8045667999999997 ] [ 0.7897612999999999 -1.2621477999999997 -6.3342564999999995 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.702210875759092e-09 1.360115462258368e-09 1.803771101778404e-08 ] [ -4.362197615222126e-09 1.156337500097849e-09 1.79771476194952e-09 ] [ 3.082868384944613e-09 -9.263291506949398e-09 7.454408772772583e-10 ] [ 1.11774281135732e-08 -1.256204694483664e-09 1.127980736070347e-09 ] [ -5.563811185037844e-09 6.112422900433905e-09 -1.141890993824398e-09 ] [ -1.126538777099747e-08 5.919719022949931e-09 -7.527123879741998e-09 ] [ -1.0364480645346e-09 -2.006915130710148e-09 -2.89123476145215e-09 ] [ 1.265337101297464e-09 -2.022183713814504e-09 -1.014859775806262e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -322.35856 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.16475352601887e-17 } }