{ "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" [ [ 1.4135894 -0.0482105 -3.2579553 ] [ -0.32641 1.3447872 0.6841334 ] [ 1.0379578 -0.4330006 0.5157365 ] [ -0.1509643 1.3036533 -0.3371039 ] [ -0.1189604 -1.6656881 1.1441906 ] [ 0.4951821 -0.9916901 -0.0967624 ] [ -0.7200991 0.3113114 0.0388773 ] [ -1.6302955 0.1788374 1.3088838 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.264819906750079e-09 -7.7241736613457e-11 -5.219819856276459e-09 ] [ -5.229664751039399e-10 2.154586629542285e-09 1.096102548018975e-09 ] [ 1.662991734238045e-09 -6.937434438279804e-10 8.26300969600941e-10 ] [ -2.418714740281662e-10 2.088682856096992e-09 -5.400999918102726e-10 ] [ -1.905955732512936e-10 -2.668726553351855e-09 1.83319544416244e-09 ] [ 7.933691901950514e-10 -1.588862706389123e-09 -1.550304563297616e-10 ] [ -1.153725952184429e-09 4.987758509778276e-10 6.228830165300819e-11 ] [ -2.612021356615347e-09 2.865291035653116e-10 2.097063040981129e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -30.310647 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.856301038482219e-18 } }