{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.46441e-10 0.0 0.0 ] "source-value" [ 5.46441 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.39301e-11 5.60761e-10 0.0 ] "source-value" [ 0.239301 5.60761 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.67861e-11 -7.33416e-11 5.71653e-10 ] "source-value" [ 0.167861 -0.733416 5.71653 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -6.095503544523953e-09 -4.07389374703537e-09 -1.431218447307143e-09 ] [ 9.05675388113777e-09 -3.142181258482842e-09 -1.750074986625007e-09 ] [ -2.399406729679451e-09 8.866953950366643e-09 5.235580104254936e-09 ] [ 8.083085193416353e-10 -1.486111581818345e-09 -4.104478016985146e-09 ] [ -1.01774137822815e-08 1.294702985611103e-08 1.066746513657911e-08 ] [ -4.690842616665529e-09 -3.216203100105099e-09 2.683054476449263e-09 ] [ 3.357606722562368e-09 1.638314996223441e-09 -2.889063147440037e-09 ] [ 1.014049755010866e-08 -1.153390927547712e-08 -8.411265279143637e-09 ] ] "source-value" [ [ -3.8045141 -2.5427245 -0.8932963 ] [ 5.6527812 -1.9611953 -1.0923109 ] [ -1.4975919 5.5343174 3.2677921 ] [ 0.5045065 -0.9275579 -2.5618137 ] [ -6.3522421 8.0809005 6.6581081 ] [ -2.9277937 -2.0073961 1.6746309 ] [ 2.0956533 1.0225558 -1.8032114 ] [ 6.3292008 -7.1989 -5.2498989 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 3.27702e-13 -3.82766e-12 4.33443e-11 ] [ 1.09616e-10 1.45225e-10 1.46895e-10 ] [ 1.30178e-11 2.57242e-10 2.88603e-10 ] [ 1.56489e-10 3.87283e-10 4.500250000000001e-10 ] [ 2.74098e-10 -2.14768e-11 2.33093e-10 ] [ 4.21449e-10 1.24218e-10 3.87733e-10 ] [ 2.20243e-10 2.94328e-10 2.28142e-11 ] [ 4.00805e-10 4.02926e-10 1.38377e-10 ] ] "source-value" [ [ 0.00327702 -0.0382766 0.433443 ] [ 1.09616 1.45225 1.46895 ] [ 0.130178 2.57242 2.88603 ] [ 1.56489 3.87283 4.50025 ] [ 2.74098 -0.214768 2.33093 ] [ 4.21449 1.24218 3.87733 ] [ 2.20243 2.94328 0.228142 ] [ 4.00805 4.02926 1.38377 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.193338096945617e-18 "source-value" -26.172758 } }