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- W2384418217 abstract "The LSDA/6-311 G(d,p) method was used to study the effect of bond length,energy and charge distribution for CH2O molecule ground state under different external electric field ranging from-0.02 to 0.02 a.u.The results show that the magnitude and direction of the external electric field have significant effects on these characteristics of CH2O molecule.The ground state bond length RCO decreases very slowly when the electric field increases,while the bond length RCH decreases.The bond angle ∠HCH,total energy and dipole decreases as the electric field increases.The external electric field influences the excitation energies and oscillator strengths both." @default.
- W2384418217 created "2016-06-24" @default.
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- W2384418217 date "2010-01-01" @default.
- W2384418217 modified "2023-09-25" @default.
- W2384418217 title "Structure and Characteristics of CH_2O Molecule under External Electric Field" @default.
- W2384418217 hasPublicationYear "2010" @default.
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