{ "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" [ 5.46441 0 0 ] "si-unit" "m" "si-value" [ 5.46441e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.239301 5.60761 0 ] "si-unit" "m" "si-value" [ 2.39301e-11 5.60761e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.167861 -0.733416 5.71653 ] "si-unit" "m" "si-value" [ 1.67861e-11 -7.33416e-11 5.71653e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00327702 -0.0382766 0.433443 ] [ 1.09616 1.45225 1.46895 ] [ 0.130178 2.57242 2.88603 ] [ 1.56489 3.87283 4.50025 ] [ 2.74098 -0.214768 2.33093 ] [ 4.21449 1.24218 3.87733 ] [ 2.20243 2.94328 0.228142 ] [ 4.00805 4.02926 1.38377 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.27702e-13 -3.82766e-12 4.33443e-11 ] [ 1.09616e-10 1.45225e-10 1.46895e-10 ] [ 1.30178e-11 2.57242e-10 2.88603e-10 ] [ 1.56489e-10 3.87283e-10 4.500250000000001e-10 ] [ 2.74098e-10 -2.14768e-11 2.33093e-10 ] [ 4.21449e-10 1.24218e-10 3.87733e-10 ] [ 2.20243e-10 2.94328e-10 2.28142e-11 ] [ 4.00805e-10 4.02926e-10 1.38377e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.8583058 -2.5606544 -1.3856823 ] [ 5.5678191 -2.0281838 -1.3097687 ] [ -2.1298239 5.9215027 2.9621562 ] [ 0.8208707 -0.30788610000000005 -3.2302596 ] [ -6.0155655 7.8007354 8.5075603 ] [ -4.8136708 -1.8192862 2.8368116 ] [ 4.1594163 0.09549759999999993 -3.4829911 ] [ 6.2692598 -7.1017253 -4.8978265 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.181687348657042e-09 -4.102620613628652e-09 -2.220107784916372e-09 ] [ 8.9206295908637e-09 -3.249508667045303e-09 -2.098480789795609e-09 ] [ -3.412354059001077e-09 9.487293185944076e-09 4.74589741079777e-09 ] [ 1.315179844239731e-09 -4.93287911289291e-10 -5.17544641023476e-09 ] [ -9.637998404991063e-09 1.249815588292694e-08 1.363061421270623e-08 ] [ -7.712350815987632e-09 -2.914817816184073e-09 4.545073223134241e-09 ] [ 6.664119552034439e-09 1.5300402206251e-10 -5.580366910874475e-09 ] [ 1.004446148128129e-08 -1.137821824300387e-08 -7.847183111034691e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -28.33393 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.539596022138374e-18 } }