Zobrazeno 1 - 2
of 2
pro vyhledávání: '"Stahl, Terrence L."'
Publikováno v:
J. Chem. Phys. 160, 204104 (2024)
Algebraic diagrammatic construction (ADC) is a computationally efficient approach for simulating excited electronic states, absorption spectra, and electron correlation. Due to their origin in perturbation theory, the single-reference ADC methods may
Externí odkaz:
http://arxiv.org/abs/2403.06241
Publikováno v:
J. Chem. Phys. 157, 044106 (2022)
Algebraic diagrammatic construction (ADC) theory is a computationally efficient and accurate approach for simulating electronic excitations in chemical systems. However, for the simulations of excited states in molecules with unpaired electrons the p
Externí odkaz:
http://arxiv.org/abs/2204.13164