{ "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" [ 5.4419 0 0 ] "si-unit" "m" "si-value" [ 5.441900000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.361794 5.44502 0 ] "si-unit" "m" "si-value" [ 3.61794e-11 5.44502e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0366443 0.298499 5.53333 ] "si-unit" "m" "si-value" [ 3.66443e-12 2.98499e-11 5.53333e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.128377 -0.150066 -0.170326 ] [ 1.39649 1.37402 1.31098 ] [ -0.0542726 2.97617 3.14736 ] [ 1.41657 4.24499 4.02908 ] [ 2.7363 -0.234712 2.6251 ] [ 4.24505 1.08558 3.99518 ] [ 2.94651 2.56191 -0.00354123 ] [ 4.33312 3.8007 1.43779 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.28377e-11 -1.50066e-11 -1.70326e-11 ] [ 1.39649e-10 1.37402e-10 1.31098e-10 ] [ -5.42726e-12 2.97617e-10 3.14736e-10 ] [ 1.41657e-10 4.24499e-10 4.02908e-10 ] [ 2.7363e-10 -2.34712e-11 2.6251e-10 ] [ 4.24505e-10 1.08558e-10 3.99518e-10 ] [ 2.94651e-10 2.56191e-10 -3.54123e-13 ] [ 4.33312e-10 3.8007e-10 1.43779e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.6852504999999995 1.3008206999999998 12.625501999999997 ] [ 1.3929163999999998 -3.0248386999999997 0.21663019999999997 ] [ 1.0433094999999997 -8.854706399999998 -7.303639999999999 ] [ 4.756016899999999 1.1920153999999998 1.6392797999999997 ] [ -1.3984050999999997 1.7262483999999998 1.1789719999999997 ] [ -5.244372499999999 4.539501999999999 -4.122728799999999 ] [ -2.7672823999999996 -0.7470154999999999 0.7057672999999999 ] [ -2.4674332999999997 3.8679740999999996 -4.939782599999999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.506598875536815e-09 2.084144530563523e-09 2.022828429692026e-08 ] [ 2.231698109195397e-09 -4.846325886758935e-09 3.470798446587467e-10 ] [ 1.671566102930222e-09 -1.418680369501025e-08 -1.170172135114776e-08 ] [ 7.619979148089112e-09 1.909819221248163e-09 2.626415792148192e-09 ] [ -2.240491976086432e-09 2.765754850959885e-09 1.888921390540247e-09 ] [ -8.402411079492163e-09 7.273084034396265e-09 -6.605339751678858e-09 ] [ -4.43367520095944e-09 -1.196850779335827e-09 1.130763877101268e-09 ] [ -3.953263979213511e-09 6.197177723937178e-09 -7.914404258759766e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -29.195683 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.677664111627101e-18 } }