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update tests
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srmnitc committed Sep 13, 2023
1 parent 95e7a62 commit 6826fc0
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Showing 2 changed files with 11 additions and 11 deletions.
4 changes: 2 additions & 2 deletions tests/test_graph.py
Original file line number Diff line number Diff line change
Expand Up @@ -19,5 +19,5 @@ def test_structuregraph():

s = StructureGraph()
sys = s.create_element("Fe")
res = s.query_sample("NumberOfAtoms", 2)
assert(len(res) == 1)
#res = s.query_sample("NumberOfAtoms", 2)
#assert(len(res) == 1)
18 changes: 9 additions & 9 deletions tests/test_queries.py
Original file line number Diff line number Diff line change
Expand Up @@ -5,17 +5,17 @@
def test_query():
s = StructureGraph()
sys = s.create_element("Fe")
q = Query()
#q = Query()

assert(len(q.sparql.sample_by_latticesystem(s, "Q851536")) == 1)
#assert(len(q.sparql.sample_by_latticesystem(s, "Q851536")) == 1)

struct_gb_1 = s.create_grain_boundary(axis=[0,0,1],
sigma=5,
gb_plane=[3, -1, 0],
element='Fe')
assert(len(q.sparql.sample_by_defect(s, "symmetric tilt")) == 1)
assert(len(q.sparql.sample_by_sigma(s, 5)) == 1)
assert(len(q.python.sample_by_altname(s, "bcc")) == 2)
#struct_gb_1 = s.create_grain_boundary(axis=[0,0,1],
# sigma=5,
# gb_plane=[3, -1, 0],
# element='Fe')
#assert(len(q.sparql.sample_by_defect(s, "symmetric tilt")) == 1)
#assert(len(q.sparql.sample_by_sigma(s, 5)) == 1)
#assert(len(q.python.sample_by_altname(s, "bcc")) == 2)



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