{ "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" [ [ 3.507764500000001 -0.20719960000000007 0.6079331000000001 ] [ -1.3537827000000002 -0.5291859000000001 -0.4459682000000001 ] [ 1.1611997000000003 0.6991278000000001 -0.6205773000000001 ] [ -2.9744499000000006 -1.2226923000000003 1.2496962000000003 ] [ 2.8629116000000003 1.5310896000000005 -1.7031064000000005 ] [ -2.3985202000000005 0.7075369000000001 -1.1542453000000001 ] [ 0.17969370000000004 -1.0583843000000002 -0.20521150000000005 ] [ -0.9848168000000003 0.07970770000000002 2.2714794000000005 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.620058319474693e-09 -3.319703576941465e-10 9.740162078551856e-10 ] [ -2.168999009453432e-09 -8.478492840222607e-10 -7.145198295470389e-10 ] [ 1.86044702674781e-09 1.120126225339825e-09 -9.942744496508083e-10 ] [ -4.765594128783637e-09 -1.958969033631718e-09 2.002234051238591e-09 ] [ 4.586890070727554e-09 2.453075981680407e-09 -2.728677279295858e-09 ] [ -3.842853020617007e-09 1.133599088872795e-09 -1.84930484956432e-09 ] [ 2.879010474170058e-10 -1.695718595252446e-09 -3.287850703280911e-10 ] [ -1.577850465730651e-09 1.277058144898818e-10 3.63931121929234e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.880683 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.748719191456101e-18 } }