{ "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" [ [ -3.633469973784699e-09 -3.452764478166219e-09 -5.76771951685733e-09 ] [ 4.935360724260866e-09 4.364346899219691e-09 4.929957864260205e-09 ] [ 2.309452202869311e-09 2.702605036664575e-09 -3.066280223902049e-09 ] [ -2.127128348646161e-09 -2.046140082859004e-09 1.805348157430661e-09 ] [ 1.278046677352435e-09 2.79091845396203e-09 -1.926897607202978e-09 ] [ -2.537838154287475e-09 -2.741547701827402e-09 3.514567640225269e-09 ] [ -1.090440446810508e-09 -9.72623107258683e-10 -1.929432571052408e-09 ] [ 8.660174792638926e-10 -6.447948595173254e-10 2.44045625709863e-09 ] ] "source-value" [ [ -2.2678336 -2.1550461 -3.5999274 ] [ 3.0804099 2.7240111 3.0770377 ] [ 1.4414467 1.6868334 -1.9138216 ] [ -1.3276491 -1.2771002 1.1268097 ] [ 0.797694 1.7419543 -1.2026749 ] [ -1.583994 -1.7111395 2.1936206 ] [ -0.6805994 -0.6070636 -1.2042571 ] [ 0.5405256 -0.4024493 1.523213 ] ] } "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" -9.821511234484509e-18 "source-value" -61.301052 } }