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MATLAB code to calculate integrals of spherical harmonics x bessel functions, for particle-in-a-sphere models

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MATLAB code to calculate integrals of spherical harmonics x bessel functions, for particle-in-a-sphere models

Send the function pis_fock4.m to a cluster or your local computer with appropriate input options

The eris are listed in 8-fold reduced format, (ij|kl), i>=j, k>=l, ij>=kl, for use with pyscf, by replacing the _eri attribute

You may need to mex the function (pis_8f_pw2) that generates the indices

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MATLAB code to calculate integrals of spherical harmonics x bessel functions, for particle-in-a-sphere models

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