{ "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" [ 5.51526 0 0 ] "si-unit" "m" "si-value" [ 5.51526e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0933018 5.35906 0 ] "si-unit" "m" "si-value" [ -9.33018e-12 5.35906e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.235006 -0.443739 5.60819 ] "si-unit" "m" "si-value" [ 2.35006e-11 -4.43739e-11 5.60819e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0139599 -0.0171452 -0.258284 ] [ 1.4668 1.50235 1.27166 ] [ -0.150248 2.65293 3.01531 ] [ 1.35939 3.8116 4.44507 ] [ 2.6266 -0.11212 2.88055 ] [ 3.83653 1.13315 3.7283 ] [ 2.72617 2.6833 0.230289 ] [ 3.93014 4.1583 1.51189 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.39599e-12 -1.71452e-12 -2.58284e-11 ] [ 1.4668e-10 1.50235e-10 1.27166e-10 ] [ -1.50248e-11 2.65293e-10 3.01531e-10 ] [ 1.35939e-10 3.8116e-10 4.44507e-10 ] [ 2.6266e-10 -1.1212e-11 2.88055e-10 ] [ 3.83653e-10 1.13315e-10 3.7283e-10 ] [ 2.72617e-10 2.6833e-10 2.30289e-11 ] [ 3.930140000000001e-10 4.1583e-10 1.51189e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.3186666 10.7125015 9.419806 ] [ -6.3196288 -5.4689335 4.6848185 ] [ 1.3001737 -0.6186487999999999 -7.328434 ] [ 7.3269076 -7.0883628 -5.4933073 ] [ -5.6471949 -2.5814745 -5.7287174 ] [ 6.7447962 5.7343592 13.12466 ] [ 0.8183364 3.8832936 -5.7200341 ] [ 4.0952764 -4.5727348 -2.9587918 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.332797314274983e-08 1.716331945358493e-08 1.509219294567156e-08 ] [ -1.012516151549436e-08 -8.762197394409918e-09 7.505906673391326e-09 ] [ 2.083107905119033e-09 -9.911846438459749e-10 -1.174144562187583e-08 ] [ 1.173900005948184e-08 -1.135680915790843e-08 -8.801248526929972e-09 ] [ -9.047803641880994e-09 -4.135978091091369e-09 -9.178417085450163e-09 ] [ 1.080635478370068e-08 9.187456245509392e-09 2.102802340794893e-08 ] [ 1.311119448029637e-09 6.221722217622268e-09 -9.16450490519877e-09 ] [ 6.56135610379399e-09 -7.326328789678564e-09 -4.74050704777475e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -26.232046 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.202837081695016e-18 } }