{ "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" [ 5.52208 0 0 ] "si-unit" "m" "si-value" [ 5.52208e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0968577 5.45697 0 ] "si-unit" "m" "si-value" [ -9.68577e-12 5.456970000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.137264 0.147448 5.57607 ] "si-unit" "m" "si-value" [ 1.37264e-11 1.47448e-11 5.57607e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0138032 0.0341723 -0.113332 ] [ 1.31844 1.45238 1.31404 ] [ 0.0088982 2.79356 2.65987 ] [ 1.44046 4.10222 4.12461 ] [ 2.80067 0.127474 2.69388 ] [ 4.04292 1.57371 4.10996 ] [ 2.66616 2.79739 -0.110182 ] [ 4.02446 4.16186 1.2374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.38032e-12 3.41723e-12 -1.13332e-11 ] [ 1.31844e-10 1.45238e-10 1.31404e-10 ] [ 8.8982e-13 2.79356e-10 2.65987e-10 ] [ 1.44046e-10 4.10222e-10 4.12461e-10 ] [ 2.80067e-10 1.27474e-11 2.69388e-10 ] [ 4.04292e-10 1.57371e-10 4.10996e-10 ] [ 2.66616e-10 2.79739e-10 -1.10182e-11 ] [ 4.024460000000001e-10 4.16186e-10 1.2374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3580069 0.1763684 -0.4953135 ] [ 0.6138696 -0.9174037 -0.4772168 ] [ -1.1501992 0.9540208 0.6110553 ] [ -1.7093077 2.1672801 -1.3829289 ] [ -0.4877901 -0.4613153 -0.1429306 ] [ 2.1817752 -1.2780188 -0.5544298 ] [ 0.1133907 -0.7691423 1.4031666 ] [ 0.7962684 0.1282108 1.0385976 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.735902899907745e-10 2.825733294559656e-10 -7.935797162047589e-10 ] [ 9.835275294429263e-10 -1.469842772085146e-09 -7.645856063122511e-10 ] [ -1.842822282685493e-09 1.528509834109987e-09 9.7901852374186e-10 ] [ -2.738612857256281e-09 3.472365535553183e-09 -2.215696370063322e-09 ] [ -7.815259005165232e-10 -7.391085945667001e-10 -2.290000676036004e-10 ] [ 3.495589246080677e-09 -2.047611859172719e-09 -8.882944707532931e-10 ] [ 1.816719300529038e-10 -1.232301821281018e-09 2.248120740129224e-09 ] [ 1.275762624872565e-09 2.054163479864472e-10 1.664016806848478e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.315754 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.818425250489203e-18 } }