{ "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" [ 5.43593 0 0 ] "si-unit" "m" "si-value" [ 5.43593e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00214695 5.43123 0 ] "si-unit" "m" "si-value" [ 2.14695e-13 5.43123e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0452237 0.0446124 5.47348 ] "si-unit" "m" "si-value" [ -4.52237e-12 4.461240000000001e-12 5.473480000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0488145 -0.0723712 0.108622 ] [ 1.36095 1.35641 1.2952 ] [ -0.00863748 2.68477 2.74572 ] [ 1.30162 4.04466 3.93872 ] [ 2.7765 -0.0432881 2.8136 ] [ 4.0674 1.36091 4.19847 ] [ 2.70508 2.80909 0.166723 ] [ 4.1715 4.08924 1.48814 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.88145e-12 -7.23712e-12 1.08622e-11 ] [ 1.36095e-10 1.35641e-10 1.2952e-10 ] [ -8.63748e-13 2.68477e-10 2.74572e-10 ] [ 1.30162e-10 4.044660000000001e-10 3.93872e-10 ] [ 2.7765e-10 -4.328810000000001e-12 2.8136e-10 ] [ 4.0674e-10 1.36091e-10 4.19847e-10 ] [ 2.70508e-10 2.80909e-10 1.66723e-11 ] [ 4.1715e-10 4.089240000000001e-10 1.48814e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.5582179 0.2073094 -1.9607285 ] [ 0.119341 -0.6713247 1.7262495 ] [ -0.0061106 -1.6027644 -0.1958562 ] [ 0.4018489 0.7357262 3.0353269 ] [ -0.5198473 1.2245399 -0.8539793 ] [ -0.6167113 0.7174784 0.373777 ] [ 0.4535578 -0.261538 -2.1114356 ] [ -1.3902964 -0.3494268 -0.0133538 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.496540289492073e-09 3.321462739520755e-10 -3.141433362436253e-09 ] [ 1.912053601028928e-10 -1.075580739305574e-09 2.76575659056769e-09 ] [ -9.79026045906048e-12 -2.56791165033054e-09 -3.13796224678729e-10 ] [ 6.438329126741971e-10 1.178763316950025e-09 4.863129795665339e-09 ] [ -8.328871904460039e-10 1.96192919901677e-09 -1.368225669107149e-09 ] [ -9.88080426643175e-10 1.149527118408991e-09 5.988567707927617e-10 ] [ 7.266797033414822e-10 -4.190300690507904e-10 -3.382892754644821e-09 ] [ -2.227500388062405e-09 -5.598434496409575e-10 -2.139514615883904e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -35.98825 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.76595327735056e-18 } }