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Spin of the ground quantum state of electrons from first principles in the representation of Feynman path integrals

机译:Feynman路径积分表示中第一性原理的电子基量子态的自旋

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A method for calculating the spin of the ground quantum state of nonrelativistic electrons and distance between energy levels of quantum states differing in the spin magnitude from first principles is proposed. The approach developed is free from the one-electron approximation and applicable in multielectron systems with allowance for all spatial correlations. The possibilities of the method are demonstrated by the example of calculating the energy gap between spin states in model ellipsoidal quantum dots with a harmonic confining field. The results of computations by the Monte Carlo method point to high sensitivity of the energy gap to the break of spherical symmetry of the quantum dot. For three electrons, the phenomenon of inversion has been revealed for levels corresponding to high and low values of the spin. The calculations demonstrate the practical possibility to obtain spin states with arbitrarily close energies by varying the shape of the quantum dot, which is a key condition for development prospects in technologies of storage systems based on spin qubits.
机译:提出了一种计算非相对论性电子的基本量子态自旋和自旋幅度与第一原理不同的量子态能级之间距离的方法。所开发的方法没有单电子近似,并且在允许所有空间相关的情况下适用于多电子系统。通过在具有谐波约束场的模型椭圆形量子点中计算自旋状态之间的能隙示例,证明了该方法的可行性。蒙特卡罗方法的计算结果表明,能隙对量子点的球形对称性破坏具有很高的敏感性。对于三个电子,对应于自旋的高值和低值的能级都显示出反转现象。计算证明了通过改变量子点的形状来获得具有任意接近能量的自旋态的现实可能性,这是基于自旋量子位的存储系统技术发展前景的关键条件。

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