Spin-Adapted Restricted Open-Shell Hartree-Fock and Its Dynamic Correlation Extension. [PDF]
Song M +4 more
europepmc +1 more source
Speeding Up Hartree-Fock in JuliaChem with Density Fitting. [PDF]
Hayes JJ, Gordon MS.
europepmc +1 more source
Molecular Quantum Computations on a Protein. [PDF]
Shajan A +9 more
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Local Pair Natural Orbital-Based Coupled-Cluster Theory through Full Quadruples (DLPNO-CCSDTQ). [PDF]
Jiang A +6 more
europepmc +1 more source
From Quantum Time to Manifestly Covariant QFT: On the Need for a Quantum-Action-Based Quantization. [PDF]
Diaz NL.
europepmc +1 more source
Convex Hartree-Fock theory for modeling ground state conical intersections. [PDF]
Rossi F, Koch H.
europepmc +1 more source
Experimental realization of para-particle oscillators. [PDF]
Huerta Alderete C +5 more
europepmc +1 more source
SCF Framework, HF Stability, and RPA Correlation for Jordan-Wigner-Transformed Spin Hamiltonians on Arbitrary Coupling Topologies. [PDF]
Tabrizi SG +3 more
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Cartesian equivariant representations for learning and understanding molecular orbitals. [PDF]
King DS +6 more
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Effects of Molecular Aggregation on Dynamic Third-Order Nonlinear Optical Responses: Oligo(thiophene-benzothiadiazole) as a Case Study. [PDF]
Ahmadzadeh K +5 more
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