source: tests/regression/Parser/Tremolo/pre/water_multipletimesteps.data@ e1e108

IndependentFragmentGrids_IntegrationTest
Last change on this file since e1e108 was efc80e, checked in by Frederik Heber <frederik.heber@…>, 8 years ago

TremoloParser::load() can deal with multiple time steps.

  • TESTS: Added regression test case.
  • ATOMDATA needs to be the same. Check by regression test case.
  • TESTS: set to XFAIL for the moment due to missing save() implementation for multiple time steps.
  • Property mode set to 100644
File size: 222 bytes
Line 
1# ATOMDATA Id type x=3 neighbors=4
21 O 0 0 0 2 3 0 0
32 H 0.759 0 0.504 1 0 0 0
43 H 0.759 0 -0.504 1 0 0 0
5# ATOMDATA Id type x=3 neighbors=4
61 O 0.001 0 0 2 3 0 0
72 H 0.761 0 0.504 1 0 0 0
83 H 0.761 0 -0.504 1 0 0 0
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