{ "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" [ 5.37928 0 0 ] "si-unit" "m" "si-value" [ 5.37928e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.109609 5.36452 0 ] "si-unit" "m" "si-value" [ -1.09609e-11 5.36452e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.116688 0.583163 5.41925 ] "si-unit" "m" "si-value" [ -1.16688e-11 5.83163e-11 5.41925e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.149607 0.163517 0.168021 ] [ 1.37749 1.37328 1.35818 ] [ 0.000964456 2.92001 2.60942 ] [ 1.4682 4.32928 3.69686 ] [ 2.55926 -0.0770152 2.34173 ] [ 4.30694 1.43375 4.42217 ] [ 2.84059 2.75554 0.271651 ] [ 3.86093 4.12935 1.26521 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.49607e-11 1.63517e-11 1.68021e-11 ] [ 1.37749e-10 1.37328e-10 1.35818e-10 ] [ 9.64456e-14 2.92001e-10 2.60942e-10 ] [ 1.4682e-10 4.32928e-10 3.69686e-10 ] [ 2.55926e-10 -7.70152e-12 2.34173e-10 ] [ 4.30694e-10 1.43375e-10 4.422170000000001e-10 ] [ 2.84059e-10 2.75554e-10 2.71651e-11 ] [ 3.86093e-10 4.12935e-10 1.26521e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 19.301789999999997 -14.391045099999998 17.351211499999998 ] [ -1.5818380999999997 4.405123999999999 -0.46306459999999994 ] [ 0.37440549999999995 -2.2002548999999996 2.0901048999999996 ] [ -5.325973399999999 -3.8107755999999995 8.903441499999998 ] [ 5.5389045999999995 6.627049399999999 2.7525971999999994 ] [ -19.085879699999996 20.056352699999998 -28.984885399999996 ] [ -2.0211258999999995 -7.061520799999999 -9.869163799999999 ] [ 2.7997169999999993 -3.6249296999999996 8.219758799999997 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.092487667759123e-08 -2.305699600809839e-08 2.77997054078561e-08 ] [ -2.534384021710692e-09 7.057786684524978e-09 -7.419112760401037e-10 ] [ 5.998637387989343e-10 -3.525196960580641e-09 3.348717205799521e-09 ] [ -8.533150064482685e-09 -6.105535573435092e-09 1.426488581596048e-08 ] [ 8.874303454961575e-09 1.061770361356667e-08 4.410146880319541e-09 ] [ -3.057895024274131e-08 3.213381939445895e-08 -4.643890574444725e-08 ] [ -3.238200664673358e-09 -1.131380353305291e-08 -1.581214350720569e-08 ] [ 4.485641122256312e-09 -5.807777617383557e-09 1.316950537797506e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -16.522121 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.647135599222871e-18 } }