{ "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" [ 5.37157 0 0 ] "si-unit" "m" "si-value" [ 5.37157e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00742946 5.44743 0 ] "si-unit" "m" "si-value" [ -7.42946e-13 5.447429999999999e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0324182 0.1292 5.41398 ] "si-unit" "m" "si-value" [ 3.24182e-12 1.292e-11 5.41398e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0294164 -0.0853048 -0.0527531 ] [ 1.50657 1.46533 1.29324 ] [ 0.0376731 2.77305 2.66982 ] [ 1.30492 4.09759 4.08062 ] [ 2.57907 0.017247 2.67471 ] [ 4.14556 1.36588 4.04305 ] [ 2.78643 2.5664 0.0569683 ] [ 4.11497 4.06206 1.21769 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.94164e-12 -8.530480000000001e-12 -5.27531e-12 ] [ 1.50657e-10 1.46533e-10 1.29324e-10 ] [ 3.76731e-12 2.77305e-10 2.66982e-10 ] [ 1.30492e-10 4.09759e-10 4.08062e-10 ] [ 2.57907e-10 1.7247e-12 2.67471e-10 ] [ 4.14556e-10 1.36588e-10 4.04305e-10 ] [ 2.78643e-10 2.5664e-10 5.69683e-12 ] [ 4.114969999999999e-10 4.06206e-10 1.21769e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1683403 1.138529 0.3891183 ] [ -3.0358878 -2.0101354 1.1513384 ] [ 0.4028696 -0.2971224 -0.3022454 ] [ 1.0229406 -0.480527 -0.0388827 ] [ 2.2910862 -0.3442658 0.0437434 ] [ -1.2759832 -0.092341 -0.600369 ] [ 0.8264436 2.0362582 -2.461882 ] [ -1.3998092 0.0496044 1.8191791 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.871887513798459e-09 1.824124545902803e-09 6.234362429854406e-10 ] [ -4.864028456531946e-09 -3.220591942522456e-09 1.844647467109279e-09 ] [ 6.454682543510478e-10 -4.760425627959859e-10 -4.842505136243443e-10 ] [ 1.638931513787125e-09 -7.698891250631616e-10 -6.229695289358015e-11 ] [ 3.670724745877513e-09 -5.515746161010087e-10 7.008465279430273e-11 ] [ -2.044350451573571e-09 -1.479465913412928e-10 -9.618971756530753e-10 ] [ 1.324108614329787e-09 3.26244528195229e-09 -3.944369783568346e-09 ] [ -2.242741573820751e-09 7.947500996881152e-11 2.914646223067985e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -27.008873 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.327298487475636e-18 } }