{ "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" [ 5.49393 0 0 ] "si-unit" "m" "si-value" [ 5.49393e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.002595 5.45604 0 ] "si-unit" "m" "si-value" [ 2.595e-13 5.45604e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0698117 0.0748179 5.57684 ] "si-unit" "m" "si-value" [ -6.981170000000001e-12 7.48179e-12 5.57684e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0568347 0.000259582 0.0366732 ] [ 1.4042 1.34788 1.25876 ] [ -0.0116956 2.70772 2.89683 ] [ 1.4664 4.01047 4.21293 ] [ 2.72042 0.0465962 2.58375 ] [ 4.04434 1.40284 4.02526 ] [ 2.59741 2.72967 0.138309 ] [ 4.11134 4.10597 1.37335 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.683470000000001e-12 2.59582e-14 3.66732e-12 ] [ 1.4042e-10 1.34788e-10 1.25876e-10 ] [ -1.16956e-12 2.70772e-10 2.89683e-10 ] [ 1.4664e-10 4.01047e-10 4.21293e-10 ] [ 2.72042e-10 4.65962e-12 2.583750000000001e-10 ] [ 4.04434e-10 1.40284e-10 4.02526e-10 ] [ 2.59741e-10 2.72967e-10 1.38309e-11 ] [ 4.11134e-10 4.10597e-10 1.37335e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6937967 -0.4287117 -1.7795443 ] [ -2.8435017 -0.5983219 2.5055377 ] [ 0.8750446 0.6508324 -2.2446162 ] [ -2.1888771 2.6518868 -1.3627149 ] [ 0.0865082 -0.8410705 2.0364633 ] [ -1.0095024 -0.5295838 2.206764 ] [ 4.2200475 0.014745 -1.8055136 ] [ 0.1664843 -0.9197763 0.443624 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.111584852328191e-09 -6.868718628034233e-10 -2.851144273137901e-09 ] [ -4.555791944945056e-09 -9.586173598926354e-10 4.014313925473004e-09 ] [ 1.401976000277288e-09 1.042748455339154e-09 -3.596271598308937e-09 ] [ -3.506967715424504e-09 4.248791031968126e-09 -2.18330995359581e-09 ] [ 1.386014155474906e-10 -1.347543491544567e-09 3.262773888377216e-09 ] [ -1.61740114392149e-09 -8.484867831144232e-10 3.535625688423091e-09 ] [ 6.761261443165488e-09 2.3624094273696e-11 -2.892751678456443e-09 ] [ 2.667372531902534e-10 -1.473644084225927e-09 7.107640012257793e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.311258 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.657487201863697e-18 } }