{ "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" [ 5.55975 0 0 ] "si-unit" "m" "si-value" [ 5.55975e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00335003 5.48819 0 ] "si-unit" "m" "si-value" [ 3.35003e-13 5.488190000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0164792 -0.0422926 5.51812 ] "si-unit" "m" "si-value" [ 1.64792e-12 -4.22926e-12 5.51812e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0695878 -0.00317054 -0.0200442 ] [ 1.39636 1.32374 1.28539 ] [ -0.0674176 2.58156 2.68412 ] [ 1.50658 3.99879 4.14654 ] [ 2.80481 -0.0668971 2.57568 ] [ 4.18687 1.32364 3.96453 ] [ 2.74594 2.77319 -0.0797703 ] [ 4.04367 4.06467 1.27465 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.958780000000001e-12 -3.17054e-13 -2.00442e-12 ] [ 1.39636e-10 1.32374e-10 1.28539e-10 ] [ -6.74176e-12 2.58156e-10 2.68412e-10 ] [ 1.50658e-10 3.99879e-10 4.14654e-10 ] [ 2.80481e-10 -6.689710000000001e-12 2.57568e-10 ] [ 4.18687e-10 1.32364e-10 3.96453e-10 ] [ 2.74594e-10 2.77319e-10 -7.97703e-12 ] [ 4.04367e-10 4.06467e-10 1.27465e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3387978 -0.3768542 -0.6034215 ] [ -0.1794299 0.1461573 -0.0007868 ] [ 0.9232753 1.2748495 -0.6278288 ] [ -1.4977956 0.9066974 -1.2168895 ] [ -0.3742541 0.235973 1.0203891 ] [ -0.9737484 -0.6043508 1.1372133 ] [ 0.6843627 -1.3605738 0.2505898 ] [ 1.0787923 -0.2218983 0.0407344 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.428139143384743e-10 -6.037869886902874e-10 -9.667878197880672e-10 ] [ -2.874783908524819e-10 2.341698090192518e-10 -1.26059256524544e-12 ] [ 1.479250100222106e-09 2.042534063938569e-09 -1.005892625224919e-09 ] [ -2.399733093057108e-09 1.452689376420146e-09 -1.949671906997002e-09 ] [ -5.996211692585453e-10 3.780704237400384e-10 1.634843560139153e-09 ] [ -1.560116921021407e-09 -9.682767225217767e-10 1.822016562122817e-09 ] [ 1.096469918087564e-09 -2.179879533233015e-09 4.014891189709478e-10 ] [ 1.72841580175906e-09 -3.555202684552646e-10 6.526370334231551e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -36.796907 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.895514411315187e-18 } }