{ "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" [ 5.43808 0 0 ] "si-unit" "m" "si-value" [ 5.438080000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.036104 5.43472 0 ] "si-unit" "m" "si-value" [ -3.6104e-12 5.434720000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0778792 -0.0548884 5.50823 ] "si-unit" "m" "si-value" [ 7.78792e-12 -5.48884e-12 5.50823e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0442028 -0.0162787 0.186746 ] [ 1.46625 1.46109 1.35616 ] [ 0.0256733 2.72542 2.65757 ] [ 1.37985 4.00669 4.1027 ] [ 2.74744 0.0130417 2.60748 ] [ 4.13581 1.33996 3.97093 ] [ 2.70334 2.70384 0.0742117 ] [ 4.06803 4.03744 1.33105 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.42028e-12 -1.62787e-12 1.86746e-11 ] [ 1.46625e-10 1.46109e-10 1.35616e-10 ] [ 2.56733e-12 2.72542e-10 2.65757e-10 ] [ 1.37985e-10 4.00669e-10 4.1027e-10 ] [ 2.74744e-10 1.30417e-12 2.60748e-10 ] [ 4.13581e-10 1.33996e-10 3.97093e-10 ] [ 2.70334e-10 2.70384e-10 7.42117e-12 ] [ 4.068030000000001e-10 4.03744e-10 1.33105e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.3533605 1.8240237 -3.9109043 ] [ -2.1652558 -2.0543607 0.8683008 ] [ 0.1948541 0.2093956 0.5491132 ] [ 0.1506648 1.0400203 0.7734463 ] [ -0.1052499 -0.8372899 1.5206202 ] [ 0.081798 -0.7721473 2.3789579 ] [ 1.1063442 0.9562996 -3.6914136 ] [ -0.6165159 -0.3659414 1.5118795 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.168322552614198e-09 2.922408127925113e-09 -6.265959435646189e-09 ] [ -3.469122220811601e-09 -3.291448684230323e-09 1.391171241581937e-09 ] [ 3.121906834870253e-10 3.354887348183885e-10 8.797763312126745e-10 ] [ 2.413916201375078e-10 1.666296209817402e-09 1.239197579304263e-09 ] [ -1.686289291215379e-10 -1.34148630261197e-09 2.43630213355622e-09 ] [ 1.310548432281984e-10 -1.237116351873844e-09 3.811510729247465e-09 ] [ 1.77255881179768e-09 1.532160861600392e-09 -5.914296567623163e-09 ] [ -9.877673613314709e-10 -5.863027556628211e-10 2.422297988366794e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.889728 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.750168312847114e-18 } }