{ "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" [ 5.43182 0 0 ] "si-unit" "m" "si-value" [ 5.43182e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00436542 5.42411 0 ] "si-unit" "m" "si-value" [ -4.36542e-13 5.42411e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.250705 -0.013062 5.36378 ] "si-unit" "m" "si-value" [ 2.50705e-11 -1.3062e-12 5.36378e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00336868 -0.0347308 0.0739509 ] [ 1.33721 1.36002 1.29514 ] [ 0.0804819 2.71297 2.74807 ] [ 1.4297 4.00589 4.14244 ] [ 2.76212 -0.0429027 2.66501 ] [ 4.31635 1.33651 3.99144 ] [ 2.62716 2.67896 0.144482 ] [ 3.97118 3.97277 1.25678 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.36868e-13 -3.47308e-12 7.395090000000001e-12 ] [ 1.33721e-10 1.36002e-10 1.29514e-10 ] [ 8.04819e-12 2.71297e-10 2.74807e-10 ] [ 1.4297e-10 4.00589e-10 4.14244e-10 ] [ 2.76212e-10 -4.29027e-12 2.66501e-10 ] [ 4.31635e-10 1.33651e-10 3.99144e-10 ] [ 2.62716e-10 2.67896e-10 1.44482e-11 ] [ 3.97118e-10 3.97277e-10 1.25678e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.7713106 2.3338643 -0.2560375 ] [ -2.0059728 -3.8402327 7.061236 ] [ 1.4916111 3.8839477 -5.5820296 ] [ 4.6733467 -2.3786684 -2.2673134 ] [ -0.8908452 1.3552253 0.8740525 ] [ -5.1059893 -4.2362695 5.3272451 ] [ -0.2169485 -0.7085136 -11.6252123 ] [ 6.8261087 3.590647 6.4680592 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.644482356876519e-09 3.739262848386766e-09 -4.102172999277749e-10 ] [ -3.213922748599555e-09 -6.152731101062731e-09 1.131334732635962e-08 ] [ 2.389824451435037e-09 6.222770252618041e-09 -8.943397395416366e-09 ] [ 7.487526885321007e-09 -3.811046930514165e-09 -3.632636551435095e-09 ] [ -1.427291363951057e-09 2.17131030946564e-09 1.400386492389285e-09 ] [ -8.180696749914015e-09 -6.787252008226862e-09 8.535187622810993e-09 ] [ -3.475898174813489e-10 -1.135163934791222e-09 -1.862564351234939e-08 ] [ 1.093663186028411e-08 5.752850724342197e-09 1.036297331756873e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -34.279973 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.492257175475088e-18 } }