{ "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" [ 5.44445 0 0 ] "si-unit" "m" "si-value" [ 5.44445e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.167308 5.39053 0 ] "si-unit" "m" "si-value" [ 1.67308e-11 5.39053e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.00577721 0.0671422 5.23553 ] "si-unit" "m" "si-value" [ 5.77721e-13 6.71422e-12 5.23553e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0663122 0.114884 -0.548352 ] [ 1.65266 1.49476 1.67932 ] [ 0.0154179 2.74054 2.60324 ] [ 1.52833 4.11061 4.06642 ] [ 2.73369 0.0515698 2.61947 ] [ 3.80738 1.47511 4.06717 ] [ 2.81179 3.14543 -0.204063 ] [ 4.02065 4.01269 1.26672 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.63122e-12 1.14884e-11 -5.48352e-11 ] [ 1.65266e-10 1.49476e-10 1.67932e-10 ] [ 1.54179e-12 2.74054e-10 2.60324e-10 ] [ 1.52833e-10 4.11061e-10 4.06642e-10 ] [ 2.733690000000001e-10 5.15698e-12 2.61947e-10 ] [ 3.807380000000001e-10 1.47511e-10 4.06717e-10 ] [ 2.81179e-10 3.14543e-10 -2.04063e-11 ] [ 4.02065e-10 4.01269e-10 1.26672e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0465701 -0.3547515 5.6056957 ] [ -3.1736857 4.4635361 -5.9375257 ] [ -0.7900048 0.1550823 2.0894569 ] [ -9.9897135 6.2822476 -12.1463417 ] [ 1.8363736 -4.4019223 3.9254771 ] [ -0.1987226 1.3981047 -3.2945497 ] [ 7.8066897 -10.8302917 8.3821419 ] [ 4.4624932 3.2879949 1.3756454 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.461352544831809e-11 -5.683745594937312e-10 8.981314593859091e-09 ] [ -5.084805030307283e-09 7.151373185516811e-09 -9.512964861939156e-09 ] [ -1.26572722087978e-09 2.484692353598918e-10 3.347678995349244e-09 ] [ -1.600528541819014e-08 1.006527023079691e-08 -1.946058469998813e-08 ] [ 2.942194848974331e-09 -7.052656995638164e-09 6.289307635105784e-09 ] [ -3.1838870374459e-10 2.240010663770598e-09 -5.278450505403654e-09 ] [ 1.250769572318017e-08 -1.735204015818429e-08 1.342967178440809e-08 ] [ 7.149702275518979e-09 5.267948558089634e-09 2.204026898391065e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -27.195681 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.357228428493477e-18 } }