{ "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" [ 5.46438 0 0 ] "si-unit" "m" "si-value" [ 5.46438e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0372754 5.43203 0 ] "si-unit" "m" "si-value" [ 3.72754e-12 5.432030000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.17857 -0.0223871 5.50346 ] "si-unit" "m" "si-value" [ 1.7857e-11 -2.23871e-12 5.503459999999999e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1412775 -0.1924001 -2.1849285 ] [ 1.6836056 0.7296679 1.7413896 ] [ 0.6461771 0.8735019 -0.9900366 ] [ -0.7831995 -0.7971896 0.4196683 ] [ -0.000442 1.5282279 -0.8824354 ] [ -0.6235336 -1.0305858 1.7749691 ] [ -0.2282754 -0.7239913 -1.1230927 ] [ 0.4469452 -0.3872309 1.2444665 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.828528128345072e-09 -3.082589420595821e-10 -3.500641360819613e-09 ] [ 2.697433530967956e-09 1.169056850328232e-09 2.790013704824264e-09 ] [ 1.035289842516344e-09 1.39950432240438e-09 -1.586213494256321e-09 ] [ -1.25482392832225e-09 -1.277238539464904e-09 6.723827387508806e-10 ] [ -7.081620663936e-13 2.448491012634281e-09 -1.413817367246296e-09 ] [ -9.99010956203259e-10 -1.651180474488465e-09 2.843813994662418e-09 ] [ -3.657375089837683e-10 -1.159961934522599e-09 -1.799392866931148e-09 ] [ 7.160851502187801e-10 -6.204122948313428e-10 1.993855131668803e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.440043038775915 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.794202922247256e-18 } }