{ "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" [ 5.45189 0 0 ] "si-unit" "m" "si-value" [ 5.451889999999999e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.103872 5.48254 0 ] "si-unit" "m" "si-value" [ 1.03872e-11 5.482540000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0133572 0.0848103 5.46172 ] "si-unit" "m" "si-value" [ -1.33572e-12 8.481030000000001e-12 5.46172e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0515087 0.139447 0.129479 ] [ 1.28089 1.29793 1.3896 ] [ -0.0267641 2.78569 2.67144 ] [ 1.28772 4.21003 3.97686 ] [ 2.71226 0.0930415 2.84614 ] [ 4.11731 1.46571 4.11351 ] [ 2.72029 2.73709 -0.0733662 ] [ 4.08924 4.18171 1.22387 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.15087e-12 1.39447e-11 1.29479e-11 ] [ 1.28089e-10 1.29793e-10 1.3896e-10 ] [ -2.67641e-12 2.78569e-10 2.67144e-10 ] [ 1.28772e-10 4.21003e-10 3.97686e-10 ] [ 2.71226e-10 9.304150000000001e-12 2.84614e-10 ] [ 4.11731e-10 1.46571e-10 4.11351e-10 ] [ 2.72029e-10 2.73709e-10 -7.336620000000001e-12 ] [ 4.089240000000001e-10 4.18171e-10 1.22387e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9326307 -3.7134087 -3.8907766 ] [ 3.505552 3.7136434 2.0673136 ] [ -0.4562834 0.2784135 -0.4046499 ] [ 0.7856493 0.2604831 1.7741906 ] [ 0.0328532 -1.1414767 -1.6288512 ] [ -0.0420961 0.2857592 0.1323801 ] [ -0.9161535 0.2009161 0.3524699 ] [ 0.0231093 0.11567 1.5979235 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.698592344980338e-09 -5.949536602615322e-09 -6.233711305275714e-09 ] [ 5.616513457398682e-09 5.949912633468223e-09 3.312201517781882e-09 ] [ -7.310465959391348e-10 4.460676006151008e-10 -6.48320609389058e-10 ] [ 1.258748940607885e-09 4.173399329335085e-10 2.842566700163125e-09 ] [ 5.263662895846656e-11 -1.828847281927935e-09 -2.609707311402025e-09 ] [ -6.744538724685887e-11 4.578367094185114e-10 2.120963012791661e-10 ] [ -1.467839718764093e-09 3.219030781623149e-10 5.647190333157139e-10 ] [ 3.702518018305344e-11 1.85323769727936e-10 2.560155673526909e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.8416 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.742457357206528e-18 } }