diff --git a/unittest/force-styles/tests/dihedral-table_linear.yaml b/unittest/force-styles/tests/dihedral-table_linear.yaml index e79aee7d47..30ac6b7f6d 100644 --- a/unittest/force-styles/tests/dihedral-table_linear.yaml +++ b/unittest/force-styles/tests/dihedral-table_linear.yaml @@ -1,7 +1,7 @@ --- -lammps_version: 17 Feb 2022 +lammps_version: 22 Dec 2022 tags: unstable -date_generated: Fri Mar 18 22:18:02 2022 +date_generated: Mon Dec 26 16:49:31 2022 epsilon: 7.5e-14 skip_tests: prerequisites: ! | @@ -21,7 +21,7 @@ extract: ! "" natoms: 29 init_energy: 789.1842567835844 init_stress: ! |- - -1.6165501104216639e+02 -7.4114380315441565e+01 2.3576939135760787e+02 -2.3488521541598647e+02 3.4341737187983938e+02 -1.5959461001900144e+02 + -6.2033369862263093e+01 1.2713175529707168e+02 -6.5098385434808534e+01 2.6651487390923656e+01 1.3493565160088829e+02 1.6234368393105845e+02 init_forces: ! |2 1 -2.1498835469576278e+01 4.0242705861631180e+01 -9.0007821437717382e+01 2 -8.2018888113291979e+00 4.2353656629457461e+00 -4.0073270940910781e+00 @@ -54,7 +54,7 @@ init_forces: ! |2 29 0.0000000000000000e+00 0.0000000000000000e+00 0.0000000000000000e+00 run_energy: 786.1991037355119 run_stress: ! |- - -1.5979555001643004e+02 -7.4781079673606996e+01 2.3457662969003690e+02 -2.3349637150864024e+02 3.4159374485946643e+02 -1.5956254217954015e+02 + -6.1892189860947845e+01 1.2738071454706946e+02 -6.5488524686121650e+01 2.6191060168800341e+01 1.3472565850695165e+02 1.6142546007899742e+02 run_forces: ! |2 1 -2.2291107377203105e+01 4.0666970718627333e+01 -9.0497211256380396e+01 2 -7.6875363073287559e+00 3.9737486142840055e+00 -3.7620801734312614e+00 diff --git a/unittest/force-styles/tests/dihedral-table_spline.yaml b/unittest/force-styles/tests/dihedral-table_spline.yaml index a9537906b5..bb38760762 100644 --- a/unittest/force-styles/tests/dihedral-table_spline.yaml +++ b/unittest/force-styles/tests/dihedral-table_spline.yaml @@ -1,6 +1,6 @@ --- -lammps_version: 17 Feb 2022 -date_generated: Fri Mar 18 22:18:02 2022 +lammps_version: 22 Dec 2022 +date_generated: Mon Dec 26 16:49:37 2022 epsilon: 1e-13 skip_tests: prerequisites: ! | @@ -20,7 +20,7 @@ extract: ! "" natoms: 29 init_energy: 789.17395865366 init_stress: ! |- - -1.6167160198618581e+02 -7.4120077515581954e+01 2.3579167950176785e+02 -2.3490764576822448e+02 3.4342184840668585e+02 -1.5962456212434762e+02 + -6.2042484205709712e+01 1.2714037705616660e+02 -6.5097892850456944e+01 2.6648135511007453e+01 1.3495574880996676e+02 1.6236422243268495e+02 init_forces: ! |2 1 -2.1511698354927645e+01 4.0249060385771472e+01 -9.0013321064696271e+01 2 -8.1931699818042816e+00 4.2308633547530370e+00 -4.0030671970615401e+00 @@ -53,7 +53,7 @@ init_forces: ! |2 29 0.0000000000000000e+00 0.0000000000000000e+00 0.0000000000000000e+00 run_energy: 786.1866360547726 run_stress: ! |- - -1.5982910389343505e+02 -7.4774149450379937e+01 2.3460325334381506e+02 -2.3353349487854388e+02 3.4161194489304893e+02 -1.5958869300328692e+02 + -6.1891690207185455e+01 1.2738938473138730e+02 -6.5497694524201904e+01 2.6197221468020043e+01 1.3475397008087896e+02 1.6145289585470724e+02 run_forces: ! |2 1 -2.2302877568136338e+01 4.0672550148970281e+01 -9.0501596555606994e+01 2 -7.6795596366469354e+00 3.9696255711631245e+00 -3.7581781934774909e+00