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Analytical energy gradient of the symmetry-adapted-cluster configuration-interaction general-R method for singlet to septet ground and excited states

机译：单线态到s态的基态和激发态的对称自适应簇构型-相互作用通用R方法的解析能梯度

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作者
Ishida M; Toyota K; Ehara M; Frisch MJ; Nakatsuji H;
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年度 2004
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正文语种 eng
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1. Analytical energy gradient of the symmetry-adapted-cluster configuration-interaction general-R method for singlet to septet ground and excited states [J] . Mayumi lshida, Kazuo Toyota, Masahiro Ehara, The Journal of Chemical Physics . 2004,第6期

机译：单线态到s态的基态和激发态的对称自适应簇构型-相互作用通用R方法的解析能梯度
2. Analytical energy gradients of the excited, ionized and electron-attached states calculated by the SAC-CI general-R method [J] . Ishida M., Ehara M., Nakatsuji H., Chemical Physics Letters . 2001,第4a6期

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3. Local CC2 response method based on the Laplace transform: Analytic energy gradients for ground and excited states [J] . Katrin Ledermüller, Martin Schütz The Journal of Chemical Physics . 2014,第16期

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4. Study of Ground and Excited Singlet-State Dipole Moments of Laser Coumarins by Electro-Optical Absorption and Emission Method [C] . Nemkovich, N.A., Baumann, . 1996

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Analytical energy gradient of the symmetry-adapted-cluster configuration-interaction general-R method for singlet to septet ground and excited states

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