{ "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" [ [ 19.246841899999996 -15.438436399999999 26.717917199999995 ] [ -1.9777869999999997 2.4680886999999996 -1.2391190999999997 ] [ 0.37942499999999996 -0.26356759999999996 -0.06638899999999999 ] [ -4.833637599999999 -4.756883299999999 6.451452999999999 ] [ 4.360223799999999 4.1412911999999995 -2.4139086999999995 ] [ -19.008363399999997 17.045025599999995 -28.929669799999996 ] [ -3.6916795999999996 -4.932984599999999 -4.124102899999999 ] [ 5.5249768999999995 1.7374663999999997 3.6038192999999996 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.083684037047216e-08 -2.473510206557507e-08 4.280682264698669e-08 ] [ -3.168764118428957e-09 3.954314045779435e-09 -1.985287668763109e-09 ] [ 6.079058693554498e-10 -4.222818501994583e-10 -1.06366904554626e-10 ] [ -7.744341219943837e-09 -7.62136727392481e-09 1.03363672519492e-08 ] [ 6.985848691370687e-09 6.635079995229819e-09 -3.867508115749314e-09 ] [ -3.045475569006079e-08 2.730914174225182e-08 -4.635044098289544e-08 ] [ -5.914722795334465e-09 -7.903512662001835e-09 -6.607541302591636e-09 ] [ 8.851988892569753e-09 2.783728068440097e-09 5.773955075618235e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.374232 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.303005864209508e-18 } }