"""Simple Harmonic Oscillator 1-Dimension""" from sympy.core.numbers import (I, Integer) from sympy.core.singleton import S from sympy.core.symbol import Symbol from sympy.functions.elementary.miscellaneous import sqrt from sympy.physics.quantum.constants import hbar from sympy.physics.quantum.operator import Operator from sympy.physics.quantum.state import Bra, Ket, State from sympy.physics.quantum.qexpr import QExpr from sympy.physics.quantum.cartesian import X, Px from sympy.functions.special.tensor_functions import KroneckerDelta from sympy.physics.quantum.hilbert import ComplexSpace from sympy.physics.quantum.matrixutils import matrix_zeros #------------------------------------------------------------------------------ class SHOOp(Operator): """A base class for the SHO Operators. We are limiting the number of arguments to be 1. """ @classmethod def _eval_args(cls, args): args = QExpr._eval_args(args) if len(args) == 1: return args else: raise ValueError("Too many arguments") @classmethod def _eval_hilbert_space(cls, label): return ComplexSpace(S.Infinity) class RaisingOp(SHOOp): """The Raising Operator or a^dagger. When a^dagger acts on a state it raises the state up by one. Taking the adjoint of a^dagger returns 'a', the Lowering Operator. a^dagger can be rewritten in terms of position and momentum. We can represent a^dagger as a matrix, which will be its default basis. Parameters ========== args : tuple The list of numbers or parameters that uniquely specify the operator. Examples ======== Create a Raising Operator and rewrite it in terms of position and momentum, and show that taking its adjoint returns 'a': >>> from sympy.physics.quantum.sho1d import RaisingOp >>> from sympy.physics.quantum import Dagger >>> ad = RaisingOp('a') >>> ad.rewrite('xp').doit() sqrt(2)*(m*omega*X - I*Px)/(2*sqrt(hbar)*sqrt(m*omega)) >>> Dagger(ad) a Taking the commutator of a^dagger with other Operators: >>> from sympy.physics.quantum import Commutator >>> from sympy.physics.quantum.sho1d import RaisingOp, LoweringOp >>> from sympy.physics.quantum.sho1d import NumberOp >>> ad = RaisingOp('a') >>> a = LoweringOp('a') >>> N = NumberOp('N') >>> Commutator(ad, a).doit() -1 >>> Commutator(ad, N).doit() -RaisingOp(a) Apply a^dagger to a state: >>> from sympy.physics.quantum import qapply >>> from sympy.physics.quantum.sho1d import RaisingOp, SHOKet >>> ad = RaisingOp('a') >>> k = SHOKet('k') >>> qapply(ad*k) sqrt(k + 1)*|k + 1> Matrix Representation >>> from sympy.physics.quantum.sho1d import RaisingOp >>> from sympy.physics.quantum.represent import represent >>> ad = RaisingOp('a') >>> represent(ad, basis=N, ndim=4, format='sympy') Matrix([ [0, 0, 0, 0], [1, 0, 0, 0], [0, sqrt(2), 0, 0], [0, 0, sqrt(3), 0]]) """ def _eval_rewrite_as_xp(self, *args, **kwargs): return (S.One/sqrt(Integer(2)*hbar*m*omega))*( S.NegativeOne*I*Px + m*omega*X) def _eval_adjoint(self): return LoweringOp(*self.args) def _eval_commutator_LoweringOp(self, other): return S.NegativeOne def _eval_commutator_NumberOp(self, other): return S.NegativeOne*self def _apply_operator_SHOKet(self, ket, **options): temp = ket.n + S.One return sqrt(temp)*SHOKet(temp) def _represent_default_basis(self, **options): return self._represent_NumberOp(None, **options) def _represent_XOp(self, basis, **options): # This logic is good but the underlying position # representation logic is broken. # temp = self.rewrite('xp').doit() # result = represent(temp, basis=X) # return result raise NotImplementedError('Position representation is not implemented') def _represent_NumberOp(self, basis, **options): ndim_info = options.get('ndim', 4) format = options.get('format','sympy') matrix = matrix_zeros(ndim_info, ndim_info, **options) for i in range(ndim_info - 1): value = sqrt(i + 1) if format == 'scipy.sparse': value = float(value) matrix[i + 1, i] = value if format == 'scipy.sparse': matrix = matrix.tocsr() return matrix #-------------------------------------------------------------------------- # Printing Methods #-------------------------------------------------------------------------- def _print_contents(self, printer, *args): arg0 = printer._print(self.args[0], *args) return '%s(%s)' % (self.__class__.__name__, arg0) def _print_contents_pretty(self, printer, *args): from sympy.printing.pretty.stringpict import prettyForm pform = printer._print(self.args[0], *args) pform = pform**prettyForm('\N{DAGGER}') return pform def _print_contents_latex(self, printer, *args): arg = printer._print(self.args[0]) return '%s^{\\dagger}' % arg class LoweringOp(SHOOp): """The Lowering Operator or 'a'. When 'a' acts on a state it lowers the state up by one. Taking the adjoint of 'a' returns a^dagger, the Raising Operator. 'a' can be rewritten in terms of position and momentum. We can represent 'a' as a matrix, which will be its default basis. Parameters ========== args : tuple The list of numbers or parameters that uniquely specify the operator. Examples ======== Create a Lowering Operator and rewrite it in terms of position and momentum, and show that taking its adjoint returns a^dagger: >>> from sympy.physics.quantum.sho1d import LoweringOp >>> from sympy.physics.quantum import Dagger >>> a = LoweringOp('a') >>> a.rewrite('xp').doit() sqrt(2)*(m*omega*X + I*Px)/(2*sqrt(hbar)*sqrt(m*omega)) >>> Dagger(a) RaisingOp(a) Taking the commutator of 'a' with other Operators: >>> from sympy.physics.quantum import Commutator >>> from sympy.physics.quantum.sho1d import LoweringOp, RaisingOp >>> from sympy.physics.quantum.sho1d import NumberOp >>> a = LoweringOp('a') >>> ad = RaisingOp('a') >>> N = NumberOp('N') >>> Commutator(a, ad).doit() 1 >>> Commutator(a, N).doit() a Apply 'a' to a state: >>> from sympy.physics.quantum import qapply >>> from sympy.physics.quantum.sho1d import LoweringOp, SHOKet >>> a = LoweringOp('a') >>> k = SHOKet('k') >>> qapply(a*k) sqrt(k)*|k - 1> Taking 'a' of the lowest state will return 0: >>> from sympy.physics.quantum import qapply >>> from sympy.physics.quantum.sho1d import LoweringOp, SHOKet >>> a = LoweringOp('a') >>> k = SHOKet(0) >>> qapply(a*k) 0 Matrix Representation >>> from sympy.physics.quantum.sho1d import LoweringOp >>> from sympy.physics.quantum.represent import represent >>> a = LoweringOp('a') >>> represent(a, basis=N, ndim=4, format='sympy') Matrix([ [0, 1, 0, 0], [0, 0, sqrt(2), 0], [0, 0, 0, sqrt(3)], [0, 0, 0, 0]]) """ def _eval_rewrite_as_xp(self, *args, **kwargs): return (S.One/sqrt(Integer(2)*hbar*m*omega))*( I*Px + m*omega*X) def _eval_adjoint(self): return RaisingOp(*self.args) def _eval_commutator_RaisingOp(self, other): return S.One def _eval_commutator_NumberOp(self, other): return self def _apply_operator_SHOKet(self, ket, **options): temp = ket.n - Integer(1) if ket.n is S.Zero: return S.Zero else: return sqrt(ket.n)*SHOKet(temp) def _represent_default_basis(self, **options): return self._represent_NumberOp(None, **options) def _represent_XOp(self, basis, **options): # This logic is good but the underlying position # representation logic is broken. # temp = self.rewrite('xp').doit() # result = represent(temp, basis=X) # return result raise NotImplementedError('Position representation is not implemented') def _represent_NumberOp(self, basis, **options): ndim_info = options.get('ndim', 4) format = options.get('format', 'sympy') matrix = matrix_zeros(ndim_info, ndim_info, **options) for i in range(ndim_info - 1): value = sqrt(i + 1) if format == 'scipy.sparse': value = float(value) matrix[i,i + 1] = value if format == 'scipy.sparse': matrix = matrix.tocsr() return matrix class NumberOp(SHOOp): """The Number Operator is simply a^dagger*a It is often useful to write a^dagger*a as simply the Number Operator because the Number Operator commutes with the Hamiltonian. And can be expressed using the Number Operator. Also the Number Operator can be applied to states. We can represent the Number Operator as a matrix, which will be its default basis. Parameters ========== args : tuple The list of numbers or parameters that uniquely specify the operator. Examples ======== Create a Number Operator and rewrite it in terms of the ladder operators, position and momentum operators, and Hamiltonian: >>> from sympy.physics.quantum.sho1d import NumberOp >>> N = NumberOp('N') >>> N.rewrite('a').doit() RaisingOp(a)*a >>> N.rewrite('xp').doit() -1/2 + (m**2*omega**2*X**2 + Px**2)/(2*hbar*m*omega) >>> N.rewrite('H').doit() -1/2 + H/(hbar*omega) Take the Commutator of the Number Operator with other Operators: >>> from sympy.physics.quantum import Commutator >>> from sympy.physics.quantum.sho1d import NumberOp, Hamiltonian >>> from sympy.physics.quantum.sho1d import RaisingOp, LoweringOp >>> N = NumberOp('N') >>> H = Hamiltonian('H') >>> ad = RaisingOp('a') >>> a = LoweringOp('a') >>> Commutator(N,H).doit() 0 >>> Commutator(N,ad).doit() RaisingOp(a) >>> Commutator(N,a).doit() -a Apply the Number Operator to a state: >>> from sympy.physics.quantum import qapply >>> from sympy.physics.quantum.sho1d import NumberOp, SHOKet >>> N = NumberOp('N') >>> k = SHOKet('k') >>> qapply(N*k) k*|k> Matrix Representation >>> from sympy.physics.quantum.sho1d import NumberOp >>> from sympy.physics.quantum.represent import represent >>> N = NumberOp('N') >>> represent(N, basis=N, ndim=4, format='sympy') Matrix([ [0, 0, 0, 0], [0, 1, 0, 0], [0, 0, 2, 0], [0, 0, 0, 3]]) """ def _eval_rewrite_as_a(self, *args, **kwargs): return ad*a def _eval_rewrite_as_xp(self, *args, **kwargs): return (S.One/(Integer(2)*m*hbar*omega))*(Px**2 + ( m*omega*X)**2) - S.Half def _eval_rewrite_as_H(self, *args, **kwargs): return H/(hbar*omega) - S.Half def _apply_operator_SHOKet(self, ket, **options): return ket.n*ket def _eval_commutator_Hamiltonian(self, other): return S.Zero def _eval_commutator_RaisingOp(self, other): return other def _eval_commutator_LoweringOp(self, other): return S.NegativeOne*other def _represent_default_basis(self, **options): return self._represent_NumberOp(None, **options) def _represent_XOp(self, basis, **options): # This logic is good but the underlying position # representation logic is broken. # temp = self.rewrite('xp').doit() # result = represent(temp, basis=X) # return result raise NotImplementedError('Position representation is not implemented') def _represent_NumberOp(self, basis, **options): ndim_info = options.get('ndim', 4) format = options.get('format', 'sympy') matrix = matrix_zeros(ndim_info, ndim_info, **options) for i in range(ndim_info): value = i if format == 'scipy.sparse': value = float(value) matrix[i,i] = value if format == 'scipy.sparse': matrix = matrix.tocsr() return matrix class Hamiltonian(SHOOp): """The Hamiltonian Operator. The Hamiltonian is used to solve the time-independent Schrodinger equation. The Hamiltonian can be expressed using the ladder operators, as well as by position and momentum. We can represent the Hamiltonian Operator as a matrix, which will be its default basis. Parameters ========== args : tuple The list of numbers or parameters that uniquely specify the operator. Examples ======== Create a Hamiltonian Operator and rewrite it in terms of the ladder operators, position and momentum, and the Number Operator: >>> from sympy.physics.quantum.sho1d import Hamiltonian >>> H = Hamiltonian('H') >>> H.rewrite('a').doit() hbar*omega*(1/2 + RaisingOp(a)*a) >>> H.rewrite('xp').doit() (m**2*omega**2*X**2 + Px**2)/(2*m) >>> H.rewrite('N').doit() hbar*omega*(1/2 + N) Take the Commutator of the Hamiltonian and the Number Operator: >>> from sympy.physics.quantum import Commutator >>> from sympy.physics.quantum.sho1d import Hamiltonian, NumberOp >>> H = Hamiltonian('H') >>> N = NumberOp('N') >>> Commutator(H,N).doit() 0 Apply the Hamiltonian Operator to a state: >>> from sympy.physics.quantum import qapply >>> from sympy.physics.quantum.sho1d import Hamiltonian, SHOKet >>> H = Hamiltonian('H') >>> k = SHOKet('k') >>> qapply(H*k) hbar*k*omega*|k> + hbar*omega*|k>/2 Matrix Representation >>> from sympy.physics.quantum.sho1d import Hamiltonian >>> from sympy.physics.quantum.represent import represent >>> H = Hamiltonian('H') >>> represent(H, basis=N, ndim=4, format='sympy') Matrix([ [hbar*omega/2, 0, 0, 0], [ 0, 3*hbar*omega/2, 0, 0], [ 0, 0, 5*hbar*omega/2, 0], [ 0, 0, 0, 7*hbar*omega/2]]) """ def _eval_rewrite_as_a(self, *args, **kwargs): return hbar*omega*(ad*a + S.Half) def _eval_rewrite_as_xp(self, *args, **kwargs): return (S.One/(Integer(2)*m))*(Px**2 + (m*omega*X)**2) def _eval_rewrite_as_N(self, *args, **kwargs): return hbar*omega*(N + S.Half) def _apply_operator_SHOKet(self, ket, **options): return (hbar*omega*(ket.n + S.Half))*ket def _eval_commutator_NumberOp(self, other): return S.Zero def _represent_default_basis(self, **options): return self._represent_NumberOp(None, **options) def _represent_XOp(self, basis, **options): # This logic is good but the underlying position # representation logic is broken. # temp = self.rewrite('xp').doit() # result = represent(temp, basis=X) # return result raise NotImplementedError('Position representation is not implemented') def _represent_NumberOp(self, basis, **options): ndim_info = options.get('ndim', 4) format = options.get('format', 'sympy') matrix = matrix_zeros(ndim_info, ndim_info, **options) for i in range(ndim_info): value = i + S.Half if format == 'scipy.sparse': value = float(value) matrix[i,i] = value if format == 'scipy.sparse': matrix = matrix.tocsr() return hbar*omega*matrix #------------------------------------------------------------------------------ class SHOState(State): """State class for SHO states""" @classmethod def _eval_hilbert_space(cls, label): return ComplexSpace(S.Infinity) @property def n(self): return self.args[0] class SHOKet(SHOState, Ket): """1D eigenket. Inherits from SHOState and Ket. Parameters ========== args : tuple The list of numbers or parameters that uniquely specify the ket This is usually its quantum numbers or its symbol. Examples ======== Ket's know about their associated bra: >>> from sympy.physics.quantum.sho1d import SHOKet >>> k = SHOKet('k') >>> k.dual >> k.dual_class() Take the Inner Product with a bra: >>> from sympy.physics.quantum import InnerProduct >>> from sympy.physics.quantum.sho1d import SHOKet, SHOBra >>> k = SHOKet('k') >>> b = SHOBra('b') >>> InnerProduct(b,k).doit() KroneckerDelta(b, k) Vector representation of a numerical state ket: >>> from sympy.physics.quantum.sho1d import SHOKet, NumberOp >>> from sympy.physics.quantum.represent import represent >>> k = SHOKet(3) >>> N = NumberOp('N') >>> represent(k, basis=N, ndim=4) Matrix([ [0], [0], [0], [1]]) """ @classmethod def dual_class(self): return SHOBra def _eval_innerproduct_SHOBra(self, bra, **hints): result = KroneckerDelta(self.n, bra.n) return result def _represent_default_basis(self, **options): return self._represent_NumberOp(None, **options) def _represent_NumberOp(self, basis, **options): ndim_info = options.get('ndim', 4) format = options.get('format', 'sympy') options['spmatrix'] = 'lil' vector = matrix_zeros(ndim_info, 1, **options) if isinstance(self.n, Integer): if self.n >= ndim_info: return ValueError("N-Dimension too small") if format == 'scipy.sparse': vector[int(self.n), 0] = 1.0 vector = vector.tocsr() elif format == 'numpy': vector[int(self.n), 0] = 1.0 else: vector[self.n, 0] = S.One return vector else: return ValueError("Not Numerical State") class SHOBra(SHOState, Bra): """A time-independent Bra in SHO. Inherits from SHOState and Bra. Parameters ========== args : tuple The list of numbers or parameters that uniquely specify the ket This is usually its quantum numbers or its symbol. Examples ======== Bra's know about their associated ket: >>> from sympy.physics.quantum.sho1d import SHOBra >>> b = SHOBra('b') >>> b.dual |b> >>> b.dual_class() Vector representation of a numerical state bra: >>> from sympy.physics.quantum.sho1d import SHOBra, NumberOp >>> from sympy.physics.quantum.represent import represent >>> b = SHOBra(3) >>> N = NumberOp('N') >>> represent(b, basis=N, ndim=4) Matrix([[0, 0, 0, 1]]) """ @classmethod def dual_class(self): return SHOKet def _represent_default_basis(self, **options): return self._represent_NumberOp(None, **options) def _represent_NumberOp(self, basis, **options): ndim_info = options.get('ndim', 4) format = options.get('format', 'sympy') options['spmatrix'] = 'lil' vector = matrix_zeros(1, ndim_info, **options) if isinstance(self.n, Integer): if self.n >= ndim_info: return ValueError("N-Dimension too small") if format == 'scipy.sparse': vector[0, int(self.n)] = 1.0 vector = vector.tocsr() elif format == 'numpy': vector[0, int(self.n)] = 1.0 else: vector[0, self.n] = S.One return vector else: return ValueError("Not Numerical State") ad = RaisingOp('a') a = LoweringOp('a') H = Hamiltonian('H') N = NumberOp('N') omega = Symbol('omega') m = Symbol('m')