{ "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" [ 5.37815 0 0 ] "si-unit" "m" "si-value" [ 5.37815e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0312137 5.76118 0 ] "si-unit" "m" "si-value" [ 3.12137e-12 5.761180000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.42726 0.0546964 4.8758 ] "si-unit" "m" "si-value" [ 4.2726e-11 5.469640000000001e-12 4.8758e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0437527 -0.0672423 0.175944 ] [ 1.47307 1.39309 1.21037 ] [ 0.198849 2.42305 2.74052 ] [ 1.63292 4.13291 3.99992 ] [ 2.96978 -0.0953104 2.87815 ] [ 4.41344 1.46946 3.21135 ] [ 3.02165 2.84712 -0.591788 ] [ 4.21555 4.28981 0.802839 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.37527e-12 -6.724230000000001e-12 1.75944e-11 ] [ 1.47307e-10 1.39309e-10 1.21037e-10 ] [ 1.98849e-11 2.42305e-10 2.74052e-10 ] [ 1.63292e-10 4.13291e-10 3.99992e-10 ] [ 2.96978e-10 -9.531040000000001e-12 2.878150000000001e-10 ] [ 4.41344e-10 1.46946e-10 3.21135e-10 ] [ 3.02165e-10 2.84712e-10 -5.91788e-11 ] [ 4.215550000000001e-10 4.28981e-10 8.02839e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.5553012 5.3127438 -4.552148 ] [ 2.1498981 -1.1982867 0.3244424 ] [ 9.6469923 10.9447561 -6.0008687 ] [ -0.2913268 -1.0170057 -2.027661 ] [ -1.5933982 -1.3206701 -4.6167028 ] [ -4.9723793 -10.2240521 5.5775669 ] [ -3.3392015 1.1900252 4.9254196 ] [ -3.1558856 -3.6875105 6.3699517 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.49186724147216e-09 8.511953978788368e-09 -7.293345160109831e-09 ] [ 3.444516501300996e-09 -1.919866951572967e-09 5.198140323588816e-10 ] [ 1.545618565143792e-08 1.753543248824896e-08 -9.614451614841954e-09 ] [ -4.667569918179912e-10 -1.629422769184813e-09 -3.248671075873074e-09 ] [ -2.552905364697658e-09 -2.115946775442443e-09 -7.396773352282374e-09 ] [ -7.966629929845276e-09 -1.638073737941863e-08 8.936247361751813e-09 ] [ -5.349990619517751e-09 1.906630569311176e-09 7.891392195765625e-09 ] [ -5.05628616789707e-09 -5.908043160729656e-09 1.020578777344858e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -24.164860292303477 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.871637452420304e-18 } }