{ "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" [ [ -0.9950515 0.4251884 -1.3371342 ] [ 1.0521949 0.3744168 1.0062997 ] [ 0.7076098 1.1371376 0.1170285 ] [ -0.4516278 -0.6684148 0.0384298 ] [ -0.09918 1.0265071 -0.2063631 ] [ -0.6179304 -0.8118211 0.3909761 ] [ -0.0060447 -1.0323906 -0.108373 ] [ 0.4100299 -0.4506234 0.099136 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.594248249791971e-09 6.812269139153588e-10 -2.142325154112111e-09 ] [ 1.685802069304994e-09 5.998818433947495e-10 1.612269852858054e-09 ] [ 1.133715878208964e-09 1.821895277352622e-09 1.875003266672928e-10 ] [ -7.235875024633383e-10 -1.070918565556708e-09 6.157132710201984e-11 ] [ -1.58903877250944e-10 1.644645676705208e-09 -3.306301342158125e-10 ] [ -9.900336401615924e-10 -1.300680786692139e-09 6.26412766711563e-10 ] [ -9.68467701974976e-12 -1.654072082853685e-09 -1.736326869259584e-10 ] [ 6.569403196089619e-10 -7.219782762654067e-10 1.588333814796288e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 148.63825 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.381447291066256e-17 } }