{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.39006e-10 0.0 0.0 ] "source-value" [ 5.39006 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.3331e-11 5.36322e-10 0.0 ] "source-value" [ 0.23331 5.36322 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.60148e-11 -2.13292e-12 5.4933e-10 ] "source-value" [ -0.160148 -0.0213292 5.4933 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -7.296565314811625e-09 3.347507081797832e-09 6.979695794938877e-09 ] [ 4.032588832662835e-10 9.162495615498624e-11 -1.52701915638892e-09 ] [ 1.088600186743857e-09 -6.394019330117126e-10 6.025988145083022e-10 ] [ 7.780411759492204e-09 -7.525699642929364e-09 -6.22295252904938e-09 ] [ -6.686449087598528e-09 4.734623214352524e-09 7.428882673217013e-09 ] [ -6.859333077389588e-10 1.72927312646885e-09 1.218381940429167e-09 ] [ -1.0767104340409e-09 9.90980686762147e-10 -1.602561944277303e-09 ] [ 6.473387314687669e-09 -2.728907810030586e-09 -6.87702575359542e-09 ] ] "source-value" [ [ -4.5541579 2.0893496 4.3563835 ] [ 0.2516944 0.0571878 -0.9530904 ] [ 0.6794508 -0.3990833 0.3761126 ] [ 4.8561511 -4.6971723 -3.8840615 ] [ -4.1733533 2.9551194 4.6367439 ] [ -0.4281259 1.0793274 0.7604542 ] [ -0.6720298 0.6185215 -1.0002405 ] [ 4.0403706 -1.7032503 -4.2923019 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.05355e-11 4.24721e-12 -3.04949e-12 ] [ 1.33629e-10 1.36991e-10 1.45967e-10 ] [ -5.353e-12 2.71357e-10 2.83859e-10 ] [ 1.26119e-10 4.17265e-10 4.20892e-10 ] [ 2.69817e-10 -7.83338e-12 2.63037e-10 ] [ 3.99124e-10 1.24872e-10 4.05842e-10 ] [ 2.76699e-10 2.61469e-10 7.47626e-12 ] [ 4.02836e-10 3.96527e-10 1.47431e-10 ] ] "source-value" [ [ 0.105355 0.0424721 -0.0304949 ] [ 1.33629 1.36991 1.45967 ] [ -0.05353 2.71357 2.83859 ] [ 1.26119 4.17265 4.20892 ] [ 2.69817 -0.0783338 2.63037 ] [ 3.99124 1.24872 4.05842 ] [ 2.76699 2.61469 0.0747626 ] [ 4.02836 3.96527 1.47431 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.540086908886266e-18 "source-value" -34.578503 } }