{ "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" [ 5.43103 0 0 ] "si-unit" "m" "si-value" [ 5.43103e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00138287 5.43667 0 ] "si-unit" "m" "si-value" [ 1.38287e-13 5.43667e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0279747 -0.147199 5.47761 ] "si-unit" "m" "si-value" [ -2.79747e-12 -1.47199e-11 5.477610000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0723979 0.065909 0.162895 ] [ 1.32756 1.26807 1.42197 ] [ -0.0160699 2.71544 2.70238 ] [ 1.33005 4.08077 4.07687 ] [ 2.7682 0.027954 2.60436 ] [ 4.1716 1.44154 4.20195 ] [ 2.84836 2.7461 0.066427 ] [ 4.17903 4.06877 1.34805 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -7.239790000000001e-12 6.5909e-12 1.62895e-11 ] [ 1.32756e-10 1.26807e-10 1.42197e-10 ] [ -1.60699e-12 2.71544e-10 2.70238e-10 ] [ 1.33005e-10 4.08077e-10 4.07687e-10 ] [ 2.7682e-10 2.7954e-12 2.60436e-10 ] [ 4.1716e-10 1.44154e-10 4.20195e-10 ] [ 2.84836e-10 2.7461e-10 6.6427e-12 ] [ 4.17903e-10 4.06877e-10 1.34805e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.6778479 -0.3401375 -3.122328 ] [ 1.1962335 2.6167219 -1.0420413 ] [ 1.1949842 0.0248415 0.8646758 ] [ 1.5949631 -0.2488991 1.2953246 ] [ 0.7067366 -0.3994874 3.6060863 ] [ -1.3209637 -2.6986866 -1.7555392 ] [ -3.5617279 0.920284 -0.7597052 ] [ -1.4880736 0.1253633 0.913527 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.688208700785969e-09 -5.449603548471749e-10 -5.002520965283952e-09 ] [ 1.916577362508039e-09 4.192450685856084e-09 -1.669534222522984e-09 ] [ 1.914575763239183e-09 3.980047085351099e-11 1.385363362745257e-09 ] [ 2.555412610912205e-09 -3.987803222436294e-10 2.075338807565396e-09 ] [ 1.132316866912604e-09 -6.400493778574116e-10 5.777587210047514e-09 ] [ -2.116417174502186e-09 -4.323772613008904e-09 -2.812683886311053e-09 ] [ -5.706517218045888e-09 1.474457521444056e-09 -1.217181920168297e-09 ] [ -2.384156751592262e-09 2.008541500211322e-10 1.463631613928118e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.654018 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.712403454781541e-18 } }