{ "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" [ 5.43385 0 0 ] "si-unit" "m" "si-value" [ 5.43385e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0231251 5.41563 0 ] "si-unit" "m" "si-value" [ 2.31251e-12 5.415630000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0358168 0.0829392 5.41654 ] "si-unit" "m" "si-value" [ -3.581680000000001e-12 8.29392e-12 5.41654e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.133361 0.0745448 0.100028 ] [ 1.34132 1.25343 1.22744 ] [ -0.0690566 2.71113 2.67907 ] [ 1.35774 4.10829 3.9369 ] [ 2.76453 -0.015077 2.69424 ] [ 4.18319 1.35081 4.12938 ] [ 2.74151 2.8117 -0.150387 ] [ 4.06649 4.0541 1.2862 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.33361e-11 7.45448e-12 1.00028e-11 ] [ 1.34132e-10 1.25343e-10 1.22744e-10 ] [ -6.90566e-12 2.71113e-10 2.67907e-10 ] [ 1.35774e-10 4.108290000000001e-10 3.9369e-10 ] [ 2.76453e-10 -1.5077e-12 2.69424e-10 ] [ 4.18319e-10 1.35081e-10 4.129380000000001e-10 ] [ 2.74151e-10 2.8117e-10 -1.50387e-11 ] [ 4.06649e-10 4.0541e-10 1.2862e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.0808862 -2.3673855 -1.2153524 ] [ 1.4159437 2.2221273 1.5666504 ] [ 1.3823954 -0.252162 -0.5725944 ] [ -1.3988635 0.6498114 0.5999343 ] [ -0.2158666 1.0054011 -0.3363553 ] [ -2.8689889 1.3517547 -1.9923047 ] [ 0.0577567 -2.1995369 1.2121932 ] [ -0.453263 -0.41001 0.7378289 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.33394724765305e-09 -3.792969731770407e-09 -1.947209217355821e-09 ] [ 2.268591911199505e-09 3.560240437833508e-09 2.510050664526754e-09 ] [ 2.214841608829084e-09 -4.040080643827079e-10 -9.173973684392494e-10 ] [ -2.241226413855459e-09 1.041112641586827e-09 9.61200717395146e-10 ] [ -3.458564225810243e-10 1.610830150217897e-09 -5.389006023820602e-10 ] [ -4.596626978785362e-09 2.16574979523968e-09 -3.19202403814838e-09 ] [ 9.253643519694779e-11 -3.524046626800794e-09 1.942147620933688e-09 ] [ -7.26207387656742e-10 -6.569084417063398e-10 1.182132223469922e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.760361 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.729441481760488e-18 } }