{ "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" [ 5.46879 0 0 ] "si-unit" "m" "si-value" [ 5.468790000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.164352 5.45396 0 ] "si-unit" "m" "si-value" [ -1.64352e-11 5.453960000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.164037 0.0480481 5.25114 ] "si-unit" "m" "si-value" [ -1.64037e-11 4.804810000000001e-12 5.251140000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.110213 -0.12035 -0.0596546 ] [ 1.31419 1.39201 1.41434 ] [ -0.168287 2.6382 2.797 ] [ 1.3034 4.08885 4.02601 ] [ 2.55869 -0.0573607 2.7167 ] [ 3.95328 1.36182 4.12861 ] [ 2.72846 2.73806 0.151815 ] [ 4.07331 4.0714 1.3741 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.10213e-11 -1.2035e-11 -5.96546e-12 ] [ 1.31419e-10 1.39201e-10 1.41434e-10 ] [ -1.68287e-11 2.6382e-10 2.797e-10 ] [ 1.3034e-10 4.08885e-10 4.02601e-10 ] [ 2.55869e-10 -5.736070000000001e-12 2.7167e-10 ] [ 3.95328e-10 1.36182e-10 4.12861e-10 ] [ 2.72846e-10 2.73806e-10 1.51815e-11 ] [ 4.07331e-10 4.0714e-10 1.3741e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.516100700000001 0.024181200000000003 1.2977390000000002 ] [ -1.0537583000000001 -0.6959911000000001 -0.3795786000000001 ] [ 1.0329585000000001 0.9167499000000002 -0.7127565000000001 ] [ -3.153151300000001 -1.1218258000000003 1.0759143000000002 ] [ 2.9849738000000006 1.4484110000000001 -1.3689202000000003 ] [ -1.9406368000000005 0.6045748000000001 -1.5414715000000005 ] [ -0.030978600000000005 -1.1111121000000002 -0.41528910000000013 ] [ -1.3555079000000003 -0.06498800000000002 2.0443625000000005 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.633414337918516e-09 3.874255330288897e-11 2.079207085700371e-09 ] [ -1.688306912233953e-09 -1.115100668704875e-09 -6.08151958675995e-10 ] [ 1.654981958956637e-09 1.468795256900738e-09 -1.141961800623236e-09 ] [ -5.051905294705129e-09 -1.797363069370257e-09 1.723804737444398e-09 ] [ 4.782455236060536e-09 2.320610241509549e-09 -2.193251940180861e-09 ] [ -3.109242910424126e-09 9.68635610084836e-10 -2.469709598929508e-09 ] [ -4.963318866511489e-11 -1.780197829707992e-09 -6.653664868930735e-10 ] [ -2.171763066689705e-09 -1.041222542325504e-10 3.275429801940241e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.722981 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.723452498348261e-18 } }