{ "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" [ 5.43385 0 0 ] "si-unit" "m" "si-value" [ 5.43385e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0231251 5.41563 0 ] "si-unit" "m" "si-value" [ 2.31251e-12 5.415630000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0358168 0.0829392 5.41654 ] "si-unit" "m" "si-value" [ -3.581680000000001e-12 8.29392e-12 5.41654e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.133361 0.0745448 0.100028 ] [ 1.34132 1.25343 1.22744 ] [ -0.0690566 2.71113 2.67907 ] [ 1.35774 4.10829 3.9369 ] [ 2.76453 -0.015077 2.69424 ] [ 4.18319 1.35081 4.12938 ] [ 2.74151 2.8117 -0.150387 ] [ 4.06649 4.0541 1.2862 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.33361e-11 7.45448e-12 1.00028e-11 ] [ 1.34132e-10 1.25343e-10 1.22744e-10 ] [ -6.90566e-12 2.71113e-10 2.67907e-10 ] [ 1.35774e-10 4.108290000000001e-10 3.9369e-10 ] [ 2.76453e-10 -1.5077e-12 2.69424e-10 ] [ 4.18319e-10 1.35081e-10 4.129380000000001e-10 ] [ 2.74151e-10 2.8117e-10 -1.50387e-11 ] [ 4.06649e-10 4.0541e-10 1.2862e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.0654642 -3.7549633 -1.0762491 ] [ 1.4329917 2.9855034 2.0356489 ] [ 1.8548345 -0.6762649 -0.8593328 ] [ -1.8743176 1.126525 0.8229913 ] [ -0.0694749 0.7554963 -0.5081418 ] [ -3.8320281 2.5327317 -2.7199292 ] [ 0.2560232 -2.8085439 1.1915199 ] [ -0.8334929 -0.1604842 1.1134928 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.911415073139375e-09 -6.016114411222017e-09 -1.724341146177041e-09 ] [ 2.295905799540447e-09 4.783303748798911e-09 3.261469075737237e-09 ] [ 2.971772471353258e-09 -1.08349581224765e-09 -1.376802921646602e-09 ] [ -3.002987838673966e-09 1.80489201774672e-09 1.318577419981799e-09 ] [ -1.113110605124179e-10 1.210438508960903e-09 -8.141329120112295e-10 ] [ -6.139585832068644e-09 4.057883516499039e-09 -4.357806974471247e-09 ] [ 4.101943854224026e-10 -4.499783375070453e-09 1.909025326997954e-09 ] [ -1.335402837982792e-09 -2.571240332477913e-10 1.78401213158913e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.414697 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.674059956611589e-18 } }