{ "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" [ 5.44972 0 0 ] "si-unit" "m" "si-value" [ 5.44972e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0609808 5.45304 0 ] "si-unit" "m" "si-value" [ -6.09808e-12 5.45304e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0674249 -0.145247 5.63878 ] "si-unit" "m" "si-value" [ -6.742489999999999e-12 -1.45247e-11 5.63878e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00897115 -0.00389651 -0.0378043 ] [ 1.32076 1.2724 1.76049 ] [ 0.246678 2.71711 2.69984 ] [ 1.36622 4.37217 4.08545 ] [ 2.70002 -0.0778066 3.30264 ] [ 4.02111 1.29847 4.36135 ] [ 2.82584 3.00896 0.436415 ] [ 4.07612 3.84466 1.60166 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.971150000000001e-13 -3.89651e-13 -3.78043e-12 ] [ 1.32076e-10 1.2724e-10 1.76049e-10 ] [ 2.46678e-11 2.71711e-10 2.69984e-10 ] [ 1.36622e-10 4.37217e-10 4.08545e-10 ] [ 2.70002e-10 -7.780660000000001e-12 3.30264e-10 ] [ 4.02111e-10 1.29847e-10 4.36135e-10 ] [ 2.82584e-10 3.00896e-10 4.36415e-11 ] [ 4.076120000000001e-10 3.84466e-10 1.60166e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.182181900000001 -3.018539800000001 2.6247457000000005 ] [ 27.286683000000007 -17.614621200000002 -16.917889500000005 ] [ -14.880485200000004 24.345501400000007 22.739022200000004 ] [ -77.68086450000001 -76.14488970000001 61.741805100000015 ] [ 73.27337350000002 59.743359300000016 -70.26320710000002 ] [ -2.7785975000000005 10.024865600000002 8.808962600000001 ] [ -64.89954930000002 -50.939259200000016 -64.31639860000001 ] [ 54.497258000000016 53.603583700000016 55.58295960000002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.302770684912925e-09 -4.83623389651431e-09 4.205306196085332e-09 ] [ 4.371808556178082e-08 -2.822173427088804e-08 -2.710544703017781e-08 ] [ -2.384116549360042e-08 3.900579316473368e-08 3.643192974869219e-08 ] [ -1.244584649854327e-07 -1.219975620707347e-07 9.892127665721023e-08 ] [ 1.173968859488463e-07 9.571941351851428e-08 -1.125740677180486e-07 ] [ -4.451803953113329e-09 1.606160529098217e-08 1.411351393122158e-08 ] [ -1.03980540588917e-07 -8.161369017111134e-08 -1.030462301709739e-07 ] [ 8.731423266530579e-08 8.588240859523599e-08 8.905371838599094e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 1.8708065 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.997362436340676e-19 } }