{ "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" [ 5.39198 0 0 ] "si-unit" "m" "si-value" [ 5.39198e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0815956 5.53401 0 ] "si-unit" "m" "si-value" [ 8.15956e-12 5.534010000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.109849 -0.0410552 5.55668 ] "si-unit" "m" "si-value" [ -1.09849e-11 -4.10552e-12 5.55668e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0600222 -0.0188866 -0.0475744 ] [ 1.35953 1.30974 1.45574 ] [ -0.0201429 2.70129 2.75612 ] [ 1.43727 3.87805 4.08993 ] [ 2.67575 -0.0837777 2.76281 ] [ 3.98871 1.3119 4.2787 ] [ 2.73779 2.77507 0.256836 ] [ 4.26747 4.05038 1.42682 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.00222e-12 -1.88866e-12 -4.75744e-12 ] [ 1.35953e-10 1.30974e-10 1.45574e-10 ] [ -2.01429e-12 2.70129e-10 2.75612e-10 ] [ 1.43727e-10 3.87805e-10 4.08993e-10 ] [ 2.67575e-10 -8.37777e-12 2.76281e-10 ] [ 3.98871e-10 1.3119e-10 4.2787e-10 ] [ 2.73779e-10 2.77507e-10 2.56836e-11 ] [ 4.26747e-10 4.05038e-10 1.42682e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.8631982000000007 -2.1358530000000004 0.9878974000000003 ] [ -1.1144764000000003 -0.061338600000000014 -0.7739255000000003 ] [ 1.6693902000000005 -2.7595573000000004 2.1465847000000005 ] [ -1.2080382000000003 3.731694100000001 1.4445906000000002 ] [ 1.0891953000000003 -0.8813683000000002 1.3895786000000003 ] [ -1.6625708000000003 1.3168552000000002 -1.7871691000000005 ] [ 0.8719948000000002 -1.9306146000000004 -3.063536800000001 ] [ -3.508693000000001 2.7201825000000004 -0.34401990000000005 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.189525837556644e-09 -3.422013742065543e-09 1.582786118029106e-09 ] [ -1.78558803251335e-09 -9.82752708726029e-11 -1.239965342340951e-09 ] [ 2.674657949432637e-09 -4.421298189817973e-09 3.439207820906983e-09 ] [ -1.935490561073315e-09 5.978833042997299e-09 2.314489285947445e-09 ] [ 1.745083245145243e-09 -1.412107684574241e-09 2.226350345683995e-09 ] [ -2.663732066184753e-09 2.109834614418908e-09 -2.863360549436178e-09 ] [ 1.397089682019172e-09 -3.093185575895144e-09 -4.908327037920447e-09 ] [ -5.621545894164616e-09 4.358212805809297e-09 -5.511806408699539e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.066011 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.618194300891564e-18 } }