Arthur 发表于 2025-3-21 16:09:51

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使服水土 发表于 2025-3-21 22:42:40

A semiclassical adiabatic calculation of state densities for molecules exhibiting torsion: applicatmechanically. The method is also formulated for reactive problems in which the density of states is parameterized by a second large amplitude degree of freedom, the reaction coordinate. The performance of the method is assessed using the dissociation reaction of the hydrogen peroxide molecule and it

entail 发表于 2025-3-22 01:32:11

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哀求 发表于 2025-3-22 06:46:48

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aneurysm 发表于 2025-3-22 09:46:58

,Vibrational energy flow across heme–cytochrome , and cytochrome ,–water interfaces,gated Fe-porphyrin system that constitutes the core of the heme–histidine complex. The ergodic threshold, which we calculate quantum mechanically, corresponds to a temperature of about 140 K. We also address the flow of excess vibrational energy from the protein to the solvent. We calculate the ther

控诉 发表于 2025-3-22 14:50:26

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控诉 发表于 2025-3-22 17:58:04

Computer simulation of quantum dynamics in a classical spin environment,metric Trotter factorization of the classical-like spin propagator are derived. Such algorithms are applied to a model comprising a quantum two-level system coupled to a single classical spin in an external magnetic field. Starting from an excited state, the population difference and the coherences

得意牛 发表于 2025-3-23 00:50:22

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VERT 发表于 2025-3-23 02:46:39

,OP-Anwendungen in Stromversorgungsgeräten,mechanically. The method is also formulated for reactive problems in which the density of states is parameterized by a second large amplitude degree of freedom, the reaction coordinate. The performance of the method is assessed using the dissociation reaction of the hydrogen peroxide molecule and it

considerable 发表于 2025-3-23 05:51:54

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