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80 积分 2025-09-08 加入
Accuracy of density functional theory in predicting formation energies of ternary oxides from binary oxides and its implication on phase stability
2天前
已完结
A comprehensive electron wavefunction analysis toolbox for chemists, Multiwfn
11天前
已完结
Electron-induced excitation of vibrations of Ce atoms inside aC80cage
16天前
已完结
MCD study on Ce@C82 and Ce2@C80 in the soft-X-ray region
16天前
已完结
Explanation of the different preferential binding sites for Ce and La in M2@C80 (M = Ce, La)—a density functional theory prediction
16天前
已完结
Element effects in endohedral metal–metal-bonding fullerenes M2@C82 (M = Sc, Y, La, Lu)
24天前
已完结
Excited-state decay dynamics of endohedral metal–metal-bonding fullerenes
24天前
已完结
Dual Stabilization of a Tri‐Metallofullerene Radical Er3@C80: Exohedral Derivatization and Endohedral Three‐Center Bonding
25天前
已完结
Dynamics and magnetic resonance properties of Sc3C2@C80 and its monoanion
25天前
已完结
Linear-Scaling Quantum Monte Carlo Calculations
1个月前
已完结
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