{ "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" [ [ 0.7367967 -0.4874833 -1.7076631 ] [ -2.1804219 -0.1805363 1.9729307 ] [ 0.7284122 0.3409099 -1.8711728 ] [ -1.8294565 2.1058054 -0.712346 ] [ 0.2042251 -0.7466794 1.509628 ] [ -0.9165055 -0.1755086 1.957323 ] [ 3.193814 -0.2153036 -1.6938038 ] [ 0.0631359 -0.6412041 0.5451039 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.180478447022591e-09 -7.810343462904326e-10 -2.735977895022852e-09 ] [ -3.493420991660315e-09 -2.892510390657351e-10 3.160983441998579e-09 ] [ 1.167044997145494e-09 5.461978715792659e-10 -2.997949313636875e-09 ] [ -2.931112433070595e-09 3.373872179834392e-09 -1.141304107120397e-09 ] [ 3.27204680600542e-10 -1.196312277912972e-09 2.418690687705062e-09 ] [ -1.468403684934614e-09 -2.811957756693389e-10 3.135977149954118e-09 ] [ 5.117054121983731e-09 -3.449543942940749e-10 -2.713772848582199e-09 ] [ 1.011548629131667e-10 -1.027322218181105e-09 8.73352724486901e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -21.331288 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.417649092515159e-18 } }