{ "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" [ 5.54387 0 0 ] "si-unit" "m" "si-value" [ 5.543870000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0557634 5.4256 0 ] "si-unit" "m" "si-value" [ 5.57634e-12 5.4256e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.136783 0.0146252 5.57946 ] "si-unit" "m" "si-value" [ -1.36783e-11 1.46252e-12 5.57946e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00414448 -0.00753772 -0.01957 ] [ 1.42138 1.28295 1.34172 ] [ -0.029535 2.68233 2.78427 ] [ 1.30944 3.95933 4.27313 ] [ 2.73162 -0.0222546 2.83084 ] [ 4.1911 1.38332 4.19541 ] [ 2.73336 2.72737 0.0657353 ] [ 3.99828 4.07749 1.28506 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.14448e-13 -7.537720000000001e-13 -1.957e-12 ] [ 1.42138e-10 1.28295e-10 1.34172e-10 ] [ -2.9535e-12 2.68233e-10 2.78427e-10 ] [ 1.30944e-10 3.95933e-10 4.27313e-10 ] [ 2.73162e-10 -2.22546e-12 2.83084e-10 ] [ 4.1911e-10 1.38332e-10 4.19541e-10 ] [ 2.73336e-10 2.72737e-10 6.57353e-12 ] [ 3.99828e-10 4.07749e-10 1.28506e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.06612790000000002 -0.8344702000000003 0.4427968000000001 ] [ -0.6149203000000001 0.3108620000000001 0.8792429000000003 ] [ -0.007799200000000002 0.24243680000000006 -0.8436716000000002 ] [ -0.3461638000000001 1.3562434000000003 -1.2587990000000002 ] [ -0.23701880000000006 -0.15960110000000002 0.28207950000000004 ] [ -1.5111909000000003 0.17732180000000003 -0.11598520000000002 ] [ 0.6183251000000001 -1.6650958000000005 -0.8566141000000003 ] [ 2.0326401000000005 0.5723031000000001 1.4709509000000003 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.059485753626004e-10 -1.336968645194301e-09 7.094386807250537e-10 ] [ -9.852109283153224e-10 4.980558286951298e-10 1.408702418384393e-09 ] [ -1.249569590094336e-11 3.884265729815655e-10 -1.35171091315293e-09 ] [ -5.546155473272872e-10 2.172941467594303e-09 -2.01681832808642e-09 ] [ -3.797459800500711e-10 -2.557091510739629e-10 4.519411801069537e-10 ] [ -2.421194729545711e-09 2.841008423181735e-10 -1.858287757988122e-10 ] [ 9.906660192738222e-10 -2.667777562152273e-09 -1.372447084067634e-09 ] [ 3.256648446720575e-09 9.169306468313646e-10 2.356723142324719e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.36842824065424 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.78272896672187e-18 } }