{ "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" [ 5.3952 0 0 ] "si-unit" "m" "si-value" [ 5.3952e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00461172 5.6034 0 ] "si-unit" "m" "si-value" [ 4.61172e-13 5.6034e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.071329 0.0469434 5.27588 ] "si-unit" "m" "si-value" [ 7.132900000000001e-12 4.694340000000001e-12 5.27588e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0148313 -0.0405976 0.0741579 ] [ 1.40662 1.33729 1.44565 ] [ 0.021393 2.68696 2.73819 ] [ 1.3197 4.02815 4.06112 ] [ 2.69728 0.0386556 2.72588 ] [ 4.00631 1.34667 3.9586 ] [ 2.7243 2.85873 -0.0805011 ] [ 4.14392 4.06243 1.15826 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.48313e-12 -4.05976e-12 7.41579e-12 ] [ 1.40662e-10 1.33729e-10 1.44565e-10 ] [ 2.1393e-12 2.68696e-10 2.73819e-10 ] [ 1.3197e-10 4.02815e-10 4.06112e-10 ] [ 2.69728e-10 3.86556e-12 2.72588e-10 ] [ 4.00631e-10 1.34667e-10 3.9586e-10 ] [ 2.7243e-10 2.85873e-10 -8.050110000000001e-12 ] [ 4.14392e-10 4.06243e-10 1.15826e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.15440890000000002 0.28417600000000004 -0.003327600000000001 ] [ 0.04272920000000001 0.043232900000000005 -0.22635550000000004 ] [ -0.09586930000000003 0.13408250000000002 -0.17673800000000003 ] [ -0.10966760000000003 0.29305960000000003 -0.19712340000000006 ] [ 0.04776490000000001 -0.49614560000000013 -0.11887770000000003 ] [ 0.058214900000000014 -0.15932830000000003 0.11468490000000003 ] [ -0.030263800000000007 -0.15263930000000003 0.20474120000000007 ] [ -0.06731710000000002 0.053562100000000015 0.40299620000000014 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.473903296234451e-10 4.553001433924609e-10 -5.331402923374082e-12 ] [ 6.845972526548738e-11 6.926674162938434e-11 -3.626614900894945e-10 ] [ -1.535995511124615e-10 2.14823846758416e-10 -2.831654916069505e-10 ] [ -1.757068647792461e-10 4.695332396209998e-10 -3.158265028926068e-10 ] [ 7.652780607484994e-11 -7.949128808327887e-10 -1.904630716744762e-10 ] [ 9.327055176220994e-11 -2.552720772918087e-10 1.83745465538786e-10 ] [ -4.848795281656705e-11 -2.445551178752775e-10 3.280315639545371e-10 ] [ -1.078538838000557e-10 8.581594438095172e-11 6.456710899112412e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 30.820451 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.937980603471198e-18 } }