帮我用python写一个关于iTEBD算法的程序
时间: 2023-05-26 13:01:44 浏览: 162
用python写的一个五子棋小程序
好的,以下是一个简单的iTEBD算法的Python程序:
```
import numpy as np
# 定义辅助函数
def get_local_operator(h, j, d):
"""
构建基于单个哈密顿量项的局部算子
"""
iden = np.identity(d)
op = np.kron(j, h) - np.kron(h, j)
op = np.reshape(op, (d, d, d, d))
op = np.transpose(op, (0, 2, 1, 3))
op = np.reshape(op, (d**2, d**2))
op -= np.kron(iden, np.conj(op))
return op
def get_bond_operator(mps_A, mps_B, S, epsilon):
"""
构建基于 MPS A 和 MPS B 的边界算子
"""
LA, RA = mps_A.shape[0], mps_B.shape[0]
m = mps_A.shape[1]
d = mps_A.shape[2]
T = np.tensordot(np.conj(mps_A), mps_B, ([0], [0]))
T = np.reshape(T, (LA*m, m*RA, d, d))
T = np.transpose(T, (0, 2, 1, 3))
T = np.reshape(T, (LA*d, m*RA*d))
U, S_new, VH = np.linalg.svd(T, full_matrices=False)
S_new = S + epsilon * S_new
S_new = S_new / np.sqrt(np.sum(np.abs(S_new)**2))
M = U @ np.diag(S_new) @ VH
M = np.reshape(M, (LA, d * m, RA, d))
M = np.transpose(M, (0, 1, 3, 2))
return M
def get_ground_state_energy(mps_A, mps_B, global_op):
"""
计算基态能量
"""
LA, RA = mps_A.shape[0], mps_B.shape[0]
d = mps_A.shape[2]
state_tensor = np.tensordot(np.conj(mps_A), mps_B, ([0], [0]))
state_tensor = np.transpose(state_tensor, (1, 0, 2))
state_tensor = np.reshape(state_tensor, (d*LA, d*RA))
E = np.trace(state_tensor @ global_op)
return E
def itebd_algorithm(mps_A, mps_B, h, j, epsilon, num_iterations):
"""
执行 iTEBD 算法
"""
S = np.ones((h.shape[1],), dtype=np.float64) / np.sqrt(h.shape[1])
global_op = get_local_operator(h, j, h.shape[1])
for i in range(num_iterations):
bond_op = get_bond_operator(mps_A, mps_B, S, epsilon)
mps_A, mps_B = np.linalg.svd(bond_op, full_matrices=False)[0:2]
S = np.diag(mps_A @ bond_op @ np.transpose(np.conj(mps_B), (0, 2, 1)))
S = S / np.sqrt(np.sum(np.abs(S)**2))
E = get_ground_state_energy(mps_A, mps_B, global_op)
print(f"Iteration {i+1}: E = {E.real}")
return mps_A, mps_B
```
使用方式举例:
```
# 初始化 MPS
LA = 4
RA = 4
m = 2
d = 3
mps_A = np.random.rand(LA, m, d)
mps_B = np.random.rand(RA, m, d)
# 执行 iTEBD 算法
h = np.random.rand(d, d)
j = np.random.rand(d, d)
epsilon = 1e-8
num_iterations = 10
itebd_algorithm(mps_A, mps_B, h, j, epsilon, num_iterations)
```
注意,这只是一个简单的实现。iTEBD算法需要针对具体的物理模型进行调整和优化,才能获得更好的结果。
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