{ "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" [ 5.46441 0 0 ] "si-unit" "m" "si-value" [ 5.46441e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.239301 5.60761 0 ] "si-unit" "m" "si-value" [ 2.39301e-11 5.60761e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.167861 -0.733416 5.71653 ] "si-unit" "m" "si-value" [ 1.67861e-11 -7.33416e-11 5.71653e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00327702 -0.0382766 0.433443 ] [ 1.09616 1.45225 1.46895 ] [ 0.130178 2.57242 2.88603 ] [ 1.56489 3.87283 4.50025 ] [ 2.74098 -0.214768 2.33093 ] [ 4.21449 1.24218 3.87733 ] [ 2.20243 2.94328 0.228142 ] [ 4.00805 4.02926 1.38377 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.27702e-13 -3.82766e-12 4.33443e-11 ] [ 1.09616e-10 1.45225e-10 1.46895e-10 ] [ 1.30178e-11 2.57242e-10 2.88603e-10 ] [ 1.56489e-10 3.87283e-10 4.500250000000001e-10 ] [ 2.74098e-10 -2.14768e-11 2.33093e-10 ] [ 4.21449e-10 1.24218e-10 3.87733e-10 ] [ 2.20243e-10 2.94328e-10 2.28142e-11 ] [ 4.00805e-10 4.02926e-10 1.38377e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.5737441 0.8953608999999999 -3.3265733 ] [ 2.5925174 -1.0506696 -0.1232564 ] [ -0.4091303 5.9678917 4.1597122 ] [ 3.9381049 3.7693703 -6.6570192 ] [ -2.198468 1.8477081000000002 5.7265098 ] [ -3.1336034 -4.2245671 6.86524 ] [ 2.5841517 -3.0944103 -4.7388395 ] [ 3.200172 -4.1106839 -1.9057737 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.053229910814194e-08 1.434526301158447e-09 -5.329757968637505e-09 ] [ 4.153670767297202e-09 -1.683358269305288e-09 -1.974785224439731e-10 ] [ -6.554990015208903e-10 9.561616557206369e-09 6.664593636096534e-09 ] [ 6.309539601037923e-09 6.039196969797882e-09 -1.066572052645672e-08 ] [ -3.522334031176935e-09 2.960354719882789e-09 9.174880120342083e-09 ] [ -5.020586106339392e-09 -6.768502640620856e-09 1.099932702418099e-08 ] [ 4.140267438340576e-09 -4.957791837822715e-09 -7.592457856623562e-09 ] [ 5.127240760938778e-09 -6.586041640078965e-09 -3.053386066675513e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -204.15276 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.270887791437934e-17 } }