{ "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" [ 5.46847 0 0 ] "si-unit" "m" "si-value" [ 5.46847e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0752926 5.44594 0 ] "si-unit" "m" "si-value" [ 7.52926e-12 5.44594e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.00412544 0.201844 5.40303 ] "si-unit" "m" "si-value" [ 4.12544e-13 2.01844e-11 5.40303e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00347607 -0.00350605 -0.096896 ] [ 1.33363 1.43287 1.45525 ] [ -0.0378093 2.6958 2.61111 ] [ 1.37012 4.12622 4.01894 ] [ 2.67267 0.0858706 2.76525 ] [ 3.9434 1.3374 3.96298 ] [ 2.74102 2.68949 -0.0467586 ] [ 4.13757 3.9786 1.32692 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.47607e-13 -3.50605e-13 -9.6896e-12 ] [ 1.33363e-10 1.43287e-10 1.45525e-10 ] [ -3.78093e-12 2.6958e-10 2.61111e-10 ] [ 1.37012e-10 4.12622e-10 4.01894e-10 ] [ 2.67267e-10 8.58706e-12 2.76525e-10 ] [ 3.9434e-10 1.3374e-10 3.96298e-10 ] [ 2.74102e-10 2.68949e-10 -4.67586e-12 ] [ 4.137570000000001e-10 3.9786e-10 1.32692e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.22987849999999999 -0.8273852999999999 1.3644144999999999 ] [ 0.9763308999999999 -1.6489864999999997 -3.0348006999999995 ] [ -0.39057149999999996 0.5680252999999998 3.1288195999999995 ] [ -0.8226463999999999 0.5233582999999999 -0.5220638999999999 ] [ -1.2188764999999997 -2.9401154999999997 -2.5595862999999994 ] [ 2.5845134999999995 3.1636796999999994 2.0655453999999995 ] [ -0.039903499999999995 -1.3930355999999997 0.6545878999999999 ] [ -0.8589681999999998 2.5544596999999998 -1.0969164999999998 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.683059583245728e-10 -1.325617384053594e-09 2.186033012980521e-09 ] [ 1.564254542144622e-09 -2.641967618314819e-09 -4.862286730327473e-09 ] [ -6.257645260507872e-10 9.10076855682906e-10 5.012921613820807e-09 ] [ -1.318024829265285e-09 8.385124325616326e-10 -8.36438575143669e-10 ] [ -1.952855431942531e-09 -4.710584316551702e-09 -4.100909328779974e-09 ] [ 4.14084710584198e-09 5.068773651039556e-09 3.309368549080984e-09 ] [ -6.393245478809279e-11 -2.2318890702621e-09 1.048765429638568e-09 ] [ -1.376218768050658e-09 4.092695610115782e-09 -1.757453971269763e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.808916 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.737220803139106e-18 } }