{ "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" [ 5.46879 0 0 ] "si-unit" "m" "si-value" [ 5.468790000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.164352 5.45396 0 ] "si-unit" "m" "si-value" [ -1.64352e-11 5.453960000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.164037 0.0480481 5.25114 ] "si-unit" "m" "si-value" [ -1.64037e-11 4.804810000000001e-12 5.251140000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.110213 -0.12035 -0.0596546 ] [ 1.31419 1.39201 1.41434 ] [ -0.168287 2.6382 2.797 ] [ 1.3034 4.08885 4.02601 ] [ 2.55869 -0.0573607 2.7167 ] [ 3.95328 1.36182 4.12861 ] [ 2.72846 2.73806 0.151815 ] [ 4.07331 4.0714 1.3741 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.10213e-11 -1.2035e-11 -5.96546e-12 ] [ 1.31419e-10 1.39201e-10 1.41434e-10 ] [ -1.68287e-11 2.6382e-10 2.797e-10 ] [ 1.3034e-10 4.08885e-10 4.02601e-10 ] [ 2.55869e-10 -5.736070000000001e-12 2.7167e-10 ] [ 3.95328e-10 1.36182e-10 4.12861e-10 ] [ 2.72846e-10 2.73806e-10 1.51815e-11 ] [ 4.07331e-10 4.0714e-10 1.3741e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.4375238000000006 -1.1752358000000003 0.33240490000000006 ] [ 2.3500000000000005e-05 0.28303020000000007 0.5019278000000001 ] [ 0.7707538000000003 0.8946679000000002 -0.7350854000000001 ] [ -3.052565700000001 -1.1211644000000003 1.1811877000000002 ] [ 1.6252380000000004 2.3673456000000006 -0.7007195000000002 ] [ -1.5663531000000004 0.6524704000000001 -1.6200716000000004 ] [ -0.3884873000000001 -1.0091932000000001 -0.31422050000000007 ] [ 0.17386700000000002 -0.8919207000000002 1.3545767000000002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.90534367717889e-09 -1.882935338200297e-09 5.325713638071066e-10 ] [ 3.765115089900001e-14 4.534643731563469e-10 8.041769931150253e-10 ] [ 1.234883728926709e-09 1.433416004569849e-09 -1.177736651874544e-09 ] [ -4.890749438289856e-09 -1.79630340455263e-09 1.892471333308202e-09 ] [ 2.603918348288892e-09 3.792905804922711e-09 -1.122676409888163e-09 ] [ -2.509574337413466e-09 1.045372829256634e-09 -2.595640862926995e-09 ] [ -6.224252746657482e-10 -1.616905764231689e-09 -5.03436743023797e-10 ] [ 2.78565644823678e-10 -1.429014504920924e-09 2.170271137700828e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -32.280913 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.171972453278684e-18 } }