{ "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" [ 5.5612 0 0 ] "si-unit" "m" "si-value" [ 5.5612e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0917257 5.43287 0 ] "si-unit" "m" "si-value" [ -9.17257e-12 5.432870000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0143429 0.0662566 5.45634 ] "si-unit" "m" "si-value" [ -1.43429e-12 6.62566e-12 5.45634e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00266051 0.00288647 -0.0538151 ] [ 1.22385 1.29926 1.47737 ] [ 0.0401458 2.69595 2.81688 ] [ 1.24418 4.12341 4.00905 ] [ 2.75119 0.03974 2.60779 ] [ 4.10264 1.45712 4.11323 ] [ 2.59294 2.8546 -0.123929 ] [ 4.00842 4.13916 1.33335 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.66051e-13 2.88647e-13 -5.38151e-12 ] [ 1.22385e-10 1.29926e-10 1.47737e-10 ] [ 4.01458e-12 2.69595e-10 2.81688e-10 ] [ 1.24418e-10 4.12341e-10 4.00905e-10 ] [ 2.75119e-10 3.974e-12 2.60779e-10 ] [ 4.10264e-10 1.45712e-10 4.11323e-10 ] [ 2.59294e-10 2.8546e-10 -1.23929e-11 ] [ 4.00842e-10 4.139160000000001e-10 1.33335e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7151653999999998 -0.11707169999999999 0.3190242999999999 ] [ 1.2059269999999997 0.9512766999999999 -1.9375080999999998 ] [ -2.2710032999999994 0.5260262999999998 -1.1435211999999997 ] [ 0.5175865999999999 1.3198822999999997 0.12213209999999998 ] [ 0.025433099999999997 0.21525449999999996 1.5131013999999998 ] [ -0.44180759999999997 -0.25751319999999994 -0.30407969999999995 ] [ 0.6467414999999999 -1.6901388999999998 1.6441185999999999 ] [ 1.0322881999999998 -0.9477158999999999 -0.21326739999999997 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.14582128388508e-09 -1.875695406973113e-10 5.111332749270854e-10 ] [ 1.932108045791481e-09 1.524113288651775e-09 -3.104230180430628e-09 ] [ -3.638548393019648e-09 8.427870397859268e-10 -1.83212293202916e-09 ] [ 8.292651497593611e-10 2.114684563267732e-09 1.956771952692076e-10 ] [ 4.074831821446848e-11 3.448757274219936e-10 2.424255687979749e-09 ] [ -7.07853807611758e-10 -4.125816285873945e-10 -4.871893861998777e-10 ] [ 1.036194111001123e-09 -2.707901031484629e-09 2.634168382742427e-09 ] [ 1.653908019967714e-09 -1.518408258140431e-09 -3.416920422588019e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -21.83088 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.497692554749031e-18 } }