{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.516260000000001e-10 0.0 0.0 ] "source-value" [ 5.51626 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.56708e-12 5.55287e-10 0.0 ] "source-value" [ 0.0156708 5.55287 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 7.073780000000001e-12 -7.79479e-12 5.31818e-10 ] "source-value" [ 0.0707378 -0.0779479 5.31818 ] } "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" [ [ -5.496002538511968e-09 3.253892542715136e-11 -4.216789476579591e-10 ] [ 4.558466458378157e-10 -1.804472888342719e-09 2.167854556823263e-09 ] [ -3.419443209895131e-09 2.186669557751966e-09 -1.341701474932143e-09 ] [ 4.197592516744489e-09 3.222602513963898e-09 -5.437923475790306e-09 ] [ -1.738397682541968e-09 -2.205623467393692e-09 5.272862273567966e-09 ] [ 2.381560564953346e-09 -1.889180767372725e-09 -1.246407534315525e-09 ] [ -2.173495500269775e-09 -8.510177415223009e-10 -1.349914552725688e-09 ] [ 5.792339203683191e-09 1.308484027706083e-09 2.356908994812732e-09 ] ] "source-value" [ [ -3.430335 0.0203092 -0.2631913 ] [ 0.2845171 -1.1262634 1.3530684 ] [ -2.1342486 1.3648118 -0.8374242 ] [ 2.6199312 2.0113903 -3.3940849 ] [ -1.0850225 -1.3766419 3.2910618 ] [ 1.4864532 -1.1791339 -0.7779464 ] [ -1.3565892 -0.5311635 -0.8425504 ] [ 3.6152938 0.8166915 1.4710669 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 4.42334e-12 -1.78769e-12 8.66315e-12 ] [ 1.37385e-10 1.41168e-10 1.32363e-10 ] [ 2.7051e-12 2.64271e-10 2.7677e-10 ] [ 1.3087e-10 3.96384e-10 4.18589e-10 ] [ 2.72942e-10 8.082370000000001e-13 2.56914e-10 ] [ 4.1019e-10 1.31789e-10 4.05807e-10 ] [ 2.73169e-10 2.7615e-10 7.42825e-12 ] [ 4.00667e-10 4.08894e-10 1.33622e-10 ] ] "source-value" [ [ 0.0442334 -0.0178769 0.0866315 ] [ 1.37385 1.41168 1.32363 ] [ 0.027051 2.64271 2.7677 ] [ 1.3087 3.96384 4.18589 ] [ 2.72942 0.00808237 2.56914 ] [ 4.1019 1.31789 4.05807 ] [ 2.73169 2.7615 0.0742825 ] [ 4.00667 4.08894 1.33622 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.662362304885468e-18 "source-value" -35.341686 } }