{ "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" [ 5.4419 0 0 ] "si-unit" "m" "si-value" [ 5.441900000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.361794 5.44502 0 ] "si-unit" "m" "si-value" [ 3.61794e-11 5.44502e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0366443 0.298499 5.53333 ] "si-unit" "m" "si-value" [ 3.66443e-12 2.98499e-11 5.53333e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.128377 -0.150066 -0.170326 ] [ 1.39649 1.37402 1.31098 ] [ -0.0542726 2.97617 3.14736 ] [ 1.41657 4.24499 4.02908 ] [ 2.7363 -0.234712 2.6251 ] [ 4.24505 1.08558 3.99518 ] [ 2.94651 2.56191 -0.00354123 ] [ 4.33312 3.8007 1.43779 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.28377e-11 -1.50066e-11 -1.70326e-11 ] [ 1.39649e-10 1.37402e-10 1.31098e-10 ] [ -5.42726e-12 2.97617e-10 3.14736e-10 ] [ 1.41657e-10 4.24499e-10 4.02908e-10 ] [ 2.7363e-10 -2.34712e-11 2.6251e-10 ] [ 4.24505e-10 1.08558e-10 3.99518e-10 ] [ 2.94651e-10 2.56191e-10 -3.54123e-13 ] [ 4.33312e-10 3.8007e-10 1.43779e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 18.149317899999996 -15.819334199999998 26.762753499999995 ] [ 0.6863105999999999 -1.0964658999999999 -0.11089779999999999 ] [ -4.264510499999999 -7.745652099999999 0.5689884999999999 ] [ 8.252084699999997 3.7289441999999995 2.0485964999999995 ] [ -1.6255361999999998 2.2851450999999994 2.4598010999999995 ] [ -19.988618199999998 17.457044199999995 -24.906105099999998 ] [ -0.20477599999999999 0.12300419999999998 -0.4259820999999999 ] [ -1.0042722999999998 1.0673143999999999 -6.3971545999999995 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.907841282284695e-08 -2.534536741186187e-08 4.287865796593337e-08 ] [ 1.09959079792722e-09 -1.756732030484431e-09 -1.776778624581542e-10 ] [ -6.832499022256117e-09 -1.240990270747042e-08 9.116200722040606e-10 ] [ 1.322129717920138e-08 5.974427217507759e-09 3.282213417752707e-09 ] [ -2.604396095904073e-09 3.661206054355677e-09 3.941035814238123e-09 ] [ -3.202529676213738e-08 2.796926808551223e-08 -3.990397930640764e-08 ] [ -3.280873197009408e-10 1.970744535002073e-10 -6.824985614992876e-10 ] [ -1.609021599977043e-09 1.710026178723179e-09 -1.024937153976317e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -56.114145 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.990477121518122e-18 } }