{ "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" [ 5.42386 0 0 ] "si-unit" "m" "si-value" [ 5.423860000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00583756 5.42008 0 ] "si-unit" "m" "si-value" [ -5.83756e-13 5.42008e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.133978 0.025245 5.31918 ] "si-unit" "m" "si-value" [ 1.33978e-11 2.5245e-12 5.31918e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0601366 -0.000139309 -0.0552929 ] [ 1.41186 1.40158 1.29827 ] [ 0.0312084 2.71899 2.71348 ] [ 1.40738 4.08238 4.03102 ] [ 2.73873 -0.00499376 2.66143 ] [ 4.093 1.3473 4.02214 ] [ 2.75009 2.74892 -0.00923085 ] [ 4.15824 4.1992 1.24093 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.01366e-12 -1.39309e-14 -5.52929e-12 ] [ 1.41186e-10 1.40158e-10 1.29827e-10 ] [ 3.12084e-12 2.71899e-10 2.71348e-10 ] [ 1.40738e-10 4.08238e-10 4.03102e-10 ] [ 2.73873e-10 -4.993760000000001e-13 2.66143e-10 ] [ 4.093e-10 1.3473e-10 4.02214e-10 ] [ 2.75009e-10 2.74892e-10 -9.23085e-13 ] [ 4.158240000000001e-10 4.1992e-10 1.24093e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.9558277000000004 2.1273491000000004 -0.24048640000000004 ] [ -0.8349948000000003 -0.6210486000000001 0.31546130000000006 ] [ -0.021055900000000002 0.4424463000000001 -0.9587657000000003 ] [ 0.4566846000000001 -0.4869468000000001 -0.6042311000000001 ] [ 0.15337330000000002 0.48145310000000013 -0.28825800000000007 ] [ 0.36334730000000004 -0.021269900000000005 -0.9291857000000002 ] [ -0.4043316000000001 0.7292538000000001 0.37747960000000014 ] [ -1.6688506000000005 -2.6512370000000005 2.3279860000000006 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.133581441069962e-09 3.40838902038093e-09 -3.853016908747777e-10 ] [ -1.337809158071503e-09 -9.950295554984123e-10 5.054247237912643e-10 ] [ -3.37352709878406e-11 7.088771236597543e-10 -1.536112002020654e-09 ] [ 7.316893952276365e-10 -7.801747849610714e-10 -9.680849499561176e-10 ] [ 2.457311175394722e-10 7.713729071868656e-10 -4.61840232163572e-10 ] [ 5.821465540869883e-10 -3.407813678751661e-11 -1.488719617186934e-09 ] [ -6.478106419078345e-10 1.168393398615709e-09 6.047889949316665e-10 ] [ -2.673793436956881e-09 -4.247749972596258e-09 3.729844773479125e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.464571 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.842268362503401e-18 } }