Esempi in Python per analyticalLowestEigenvalue

Esempio n. 1

 def test2(self):
     lval, lvec = analyticalLowestEigenvalue(self.x, self.pot)
     ret = findLowestEigenVector(self.x.copy(), self.pot)
     self.assertLess(np.abs(ret.eigenval - lval) / np.abs(lval), 1e-2)

Esempio n. 2

File: _test_find_lowest_eigenvector.py Progetto: js850/pele

 def test2(self):
     lval, lvec = analyticalLowestEigenvalue(self.x, self.pot)
     ret = findLowestEigenVector(self.x.copy(), self.pot)
     self.assertLess(np.abs(ret.eigenval - lval) / np.abs(lval), 1e-2)

Esempio n. 3

 def test(self):
     lval, lvec = analyticalLowestEigenvalue(self.x, self.pot)
     ret = self.finder.run(100)
     self.assertLess(np.abs(ret.eigenval - lval) / np.abs(lval), 1e-2)

Esempio n. 4

File: _test_find_lowest_eigenvector.py Progetto: js850/pele

 def test(self):
     lval, lvec = analyticalLowestEigenvalue(self.x, self.pot)
     ret = self.finder.run(100)
     self.assertLess(np.abs(ret.eigenval - lval) / np.abs(lval), 1e-2)