{ "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" [ 5.54692 0 0 ] "si-unit" "m" "si-value" [ 5.54692e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.123956 5.52099 0 ] "si-unit" "m" "si-value" [ 1.23956e-11 5.520990000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.202669 -0.109883 5.46638 ] "si-unit" "m" "si-value" [ 2.02669e-11 -1.09883e-11 5.466380000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.000314992 -0.0047744 0.0104344 ] [ 1.40487 1.33719 1.19876 ] [ 0.131099 2.68123 2.80213 ] [ 1.67848 4.08836 4.2255 ] [ 2.84099 -0.0865799 2.6392 ] [ 4.04763 1.27038 4.03721 ] [ 2.8307 2.64898 -0.0339665 ] [ 4.22323 4.11032 1.34741 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.14992e-14 -4.7744e-13 1.04344e-12 ] [ 1.40487e-10 1.33719e-10 1.19876e-10 ] [ 1.31099e-11 2.68123e-10 2.80213e-10 ] [ 1.67848e-10 4.08836e-10 4.225500000000001e-10 ] [ 2.84099e-10 -8.65799e-12 2.639200000000001e-10 ] [ 4.04763e-10 1.27038e-10 4.03721e-10 ] [ 2.8307e-10 2.64898e-10 -3.39665e-12 ] [ 4.22323e-10 4.11032e-10 1.34741e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8024241 0.3434668 -0.5308035 ] [ 0.3051545 -0.0901435 2.0188255 ] [ -0.3519659 0.3292613 -0.4089221 ] [ -0.1566908 -1.0118264 -1.704389 ] [ -1.786776 0.4430113 0.4266536 ] [ 3.624963 -0.939758 -0.5189739 ] [ -1.1662505 2.05736 1.0473349 ] [ 1.3339898 -1.1313714 -0.3297255 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.887801753786482e-09 5.502944769809895e-10 -8.504409579388128e-10 ] [ 4.889114056319136e-10 -1.444258082170848e-10 3.234515017574871e-09 ] [ -5.639115362988308e-10 5.27534756994215e-10 -6.551654283484396e-10 ] [ -2.510463364544486e-10 -1.621124602388229e-09 -2.730732208548691e-09 ] [ -2.862730733806541e-09 7.097823476102151e-10 6.83574423100155e-10 ] [ 5.807830969865031e-09 -1.505658296809766e-09 -8.314878493853971e-10 ] [ -1.868539285096311e-09 3.296254092569088e-09 1.678015490927906e-09 ] [ 2.137287269945668e-09 -1.812656806521765e-09 -5.282784873815904e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -26.168227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.192612150718733e-18 } }