molecules in the box -- page 10 (index 091 - 100)


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(091) ensemble Sutton-Chen potential MD3D molecular dynamics 3D, Sutton-Chen potential, bcc crystal
(092) Li like atom LSD DFT-local spin density approximation, Li, Be,..., Ne
(093) electron QED3D quantum electron dynamics 3D
(094) alkali atom LDA3D DFT-LDA, empty core pseudo-potential, alkali atom
(095) 3rd-period atom DFT-LDA, Na, Mg, Al, Si, P, S, Cl, Ar
(096) H2 molecule DMC3D diffusion Monte-Carlo method, lowest energy state only
(097) simple metal LDA3D DFT-LDA, Heine-Abarenkov pseudo-potential
(098) time dependent Kohn-Sham 1D electrons in parabolic potential
(099) time dependent Kohn-Sham 2D electrons in parabolic potential
(100) time dependent Kohn-Sham 3D electrons in parabolic potential

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Copyright(C) 2018 Mitsuru Ikeuchi
Released under the MIT license

(created 2018.02.09, last updated 2019.03.19)
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