{ "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" [ [ -0.20153559999999998 -0.5606043999999999 1.2185141999999998 ] [ 0.6569191999999999 -1.1300712999999998 -2.2617231999999996 ] [ -0.43634199999999995 0.46046819999999994 2.1158240999999998 ] [ -0.7567169999999999 0.3588702999999999 -0.41486029999999996 ] [ -0.7047822999999999 -2.3492876999999996 -1.9022694999999998 ] [ 1.8885853999999997 2.0719621999999998 1.4705183999999998 ] [ 0.07679349999999999 -0.8784618999999999 0.5566266999999999 ] [ -0.5229213999999999 2.0271246999999994 -0.7826304999999999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.228956292391704e-10 -8.981872705975893e-10 1.952274979437202e-09 ] [ 1.052500592665972e-09 -1.810573831614004e-09 -3.623680063615708e-09 ] [ -6.990969568328278e-10 7.377513907400386e-10 3.389923934674079e-09 ] [ -1.212394295950578e-09 5.7497360929657e-10 -6.646794790342301e-10 ] [ -1.129185733116778e-09 -3.763973859483601e-09 -3.047771744470862e-09 ] [ 3.025847399193543e-09 3.319649423371234e-09 2.356030220347065e-09 ] [ 1.23036751343079e-10 -1.407451130039244e-09 8.918142926005277e-10 ] [ -8.378124484985673e-10 3.247811828544258e-09 -1.253912300155737e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.850032074190157 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.141631737741802e-18 } }