{ "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" [ 5.43182 0 0 ] "si-unit" "m" "si-value" [ 5.43182e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00436542 5.42411 0 ] "si-unit" "m" "si-value" [ -4.36542e-13 5.42411e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.250705 -0.013062 5.36378 ] "si-unit" "m" "si-value" [ 2.50705e-11 -1.3062e-12 5.36378e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00336868 -0.0347308 0.0739509 ] [ 1.33721 1.36002 1.29514 ] [ 0.0804819 2.71297 2.74807 ] [ 1.4297 4.00589 4.14244 ] [ 2.76212 -0.0429027 2.66501 ] [ 4.31635 1.33651 3.99144 ] [ 2.62716 2.67896 0.144482 ] [ 3.97118 3.97277 1.25678 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.36868e-13 -3.47308e-12 7.395090000000001e-12 ] [ 1.33721e-10 1.36002e-10 1.29514e-10 ] [ 8.04819e-12 2.71297e-10 2.74807e-10 ] [ 1.4297e-10 4.00589e-10 4.14244e-10 ] [ 2.76212e-10 -4.29027e-12 2.66501e-10 ] [ 4.31635e-10 1.33651e-10 3.99144e-10 ] [ 2.62716e-10 2.67896e-10 1.44482e-11 ] [ 3.97118e-10 3.97277e-10 1.25678e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.0179163 0.8468251 -0.8217812 ] [ -0.1976864 -1.4232014 2.9604431 ] [ -0.1253972 1.2131058 -2.0057303 ] [ 1.9114773 -0.4583575 -1.0616731 ] [ -0.17837 0.697474 0.6297078 ] [ -2.2042447 -1.5553485 1.8431593 ] [ 0.3016281 -0.3959929 -4.5468192 ] [ 2.5105092 1.0754953 3.0026936 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.233058318591239e-09 1.356763377126622e-09 -1.316638626052969e-09 ] [ -3.167285283301172e-10 -2.280220009769829e-09 4.743152722028676e-09 ] [ -2.009084621537817e-10 1.943609751316881e-09 -3.213534194290171e-09 ] [ 3.062524241249908e-09 -7.343696704683359e-10 -1.70098781975226e-09 ] [ -2.85780243852096e-10 1.117476536415859e-09 1.008903115095402e-09 ] [ -3.53158932486231e-09 -2.491943003896349e-09 2.953066738870094e-09 ] [ 4.832614899963245e-10 -6.344505663827924e-10 -7.284807421244559e-09 ] [ 4.022279146543312e-09 1.723133425440282e-09 4.810845485345787e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.889404 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.7501164023246e-18 } }