{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.46438e-10 0.0 0.0 ] "source-value" [ 5.46438 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.72754e-12 5.432030000000001e-10 0.0 ] "source-value" [ 0.0372754 5.43203 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.7857e-11 -2.23871e-12 5.503459999999999e-10 ] "source-value" [ 0.17857 -0.0223871 5.50346 ] } "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" [ [ -3.189307200954068e-10 1.362821046712205e-10 -4.285737545279098e-10 ] [ 3.372458419184198e-10 1.200060730334995e-10 3.225354572745447e-10 ] [ 2.268009180872064e-10 3.644717894533363e-10 3.751144078746624e-11 ] [ -1.447539339890246e-10 -2.142382512035136e-10 1.231641233707584e-11 ] [ -3.178942720394111e-11 3.290132175701011e-10 -6.6141856348176e-11 ] [ -1.98057068421744e-10 -2.602021349716724e-10 1.253131228722374e-10 ] [ -1.93687131688512e-12 -3.309001009764173e-10 -3.473470848595776e-11 ] [ 1.314214212390374e-10 -1.444326975765543e-10 3.177388609071936e-11 ] ] "source-value" [ [ -0.1990609 0.0850606 -0.2674947 ] [ 0.2104923 0.0749019 0.2013108 ] [ 0.141558 0.2274854 0.0234128 ] [ -0.0903483 -0.133717 0.0076873 ] [ -0.0198414 0.2053539 -0.0412825 ] [ -0.1236175 -0.1624054 0.0782143 ] [ -0.0012089 -0.2065316 -0.0216797 ] [ 0.0820268 -0.0901478 0.0198317 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 7.26127e-13 1.0583e-12 3.36114e-13 ] [ 1.28417e-10 1.2786e-10 1.26313e-10 ] [ 7.944210000000001e-12 2.71348e-10 2.73185e-10 ] [ 1.57701e-10 4.05847e-10 4.12903e-10 ] [ 2.78941e-10 -1.59624e-11 2.68623e-10 ] [ 4.22148e-10 1.3448e-10 3.91745e-10 ] [ 2.73822e-10 2.68922e-10 9.39316e-13 ] [ 4.14349e-10 4.04668e-10 1.21083e-10 ] ] "source-value" [ [ 0.00726127 0.010583 0.00336114 ] [ 1.28417 1.2786 1.26313 ] [ 0.0794421 2.71348 2.73185 ] [ 1.57701 4.05847 4.12903 ] [ 2.78941 -0.159624 2.68623 ] [ 4.22148 1.3448 3.91745 ] [ 2.73822 2.68922 0.00939316 ] [ 4.14349 4.04668 1.21083 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 4.764152931650488e-18 "source-value" 29.735504 } }