{ "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" [ 5.40836 0 0 ] "si-unit" "m" "si-value" [ 5.40836e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0676972 5.56169 0 ] "si-unit" "m" "si-value" [ 6.76972e-12 5.561689999999999e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0290382 0.0456166 5.46301 ] "si-unit" "m" "si-value" [ 2.90382e-12 4.56166e-12 5.46301e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.160852 -0.0174641 0.0414383 ] [ 1.3693 1.3835 1.35672 ] [ 0.168786 2.76991 2.61562 ] [ 1.32577 4.00891 4.07743 ] [ 2.71647 0.0672876 2.67609 ] [ 4.01486 1.47906 4.19059 ] [ 2.74225 2.69331 -0.0428987 ] [ 4.04746 4.06755 1.1226 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.60852e-11 -1.74641e-12 4.14383e-12 ] [ 1.3693e-10 1.3835e-10 1.35672e-10 ] [ 1.68786e-11 2.76991e-10 2.61562e-10 ] [ 1.32577e-10 4.008910000000001e-10 4.07743e-10 ] [ 2.71647e-10 6.728760000000001e-12 2.67609e-10 ] [ 4.01486e-10 1.47906e-10 4.19059e-10 ] [ 2.74225e-10 2.69331e-10 -4.28987e-12 ] [ 4.04746e-10 4.06755e-10 1.1226e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5990464 -0.2056581 -0.7547594 ] [ 0.0608374 -0.6575391 0.2932342 ] [ -2.1097846 0.477011 0.2198877 ] [ 0.1564592 1.5549398 -0.6446752 ] [ 1.3287861 -1.4509177 1.0009123 ] [ 1.5610764 -1.6764321 -1.6552427 ] [ -0.6702207 0.5358575 0.1879751 ] [ 0.2718925 1.4227387 1.352668 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.597781368544052e-10 -3.295005996981485e-10 -1.209257865009035e-09 ] [ 9.747225995025792e-11 -1.053493773281873e-09 4.698129796589914e-10 ] [ -3.380247561043879e-09 7.642558720644289e-10 3.522989321414841e-10 ] [ 2.506752723490714e-10 2.491288194311428e-09 -1.032883533449564e-09 ] [ 2.128950023464011e-09 -2.324626417644908e-09 1.603638286531156e-09 ] [ 2.501120111362629e-09 -2.685940316978648e-09 -2.651991155689868e-09 ] [ -1.07381193631621e-09 8.58538358580336e-10 3.011693105125421e-10 ] [ 4.35619806870864e-10 2.279478682647385e-09 2.167213045304294e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 147.96322 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.37063211822287e-17 } }