崔 隆基

Multinuclear palladium compounds containing palladium centers ligated by five silicon atoms 

PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA 104(19) 7758-7763 2007年5月  

First-principles molecular dynamics study on aqueous sulfuric acid solutions 

JOURNAL OF CHEMICAL PHYSICS 126(15) 154510 -154510-9 2007年4月  

Theoretical study of the electronic spectra of oxidized and reduced states of lumiflavin and its derivative 

JOURNAL OF COMPUTATIONAL CHEMISTRY 28(4) 727-739 2007年3月  

Effect of the axial cysteine ligand on the electronic structure and reactivity of high-valent iron(IV) oxo-porphyrins (Compound I): A theoretical study 

JOURNAL OF COMPUTATIONAL CHEMISTRY 26(15) 1600-1611 2005年11月  

Multireference Moller-Plesset method with a complete active space configuration interaction reference function 

JOURNAL OF CHEMICAL PHYSICS 115(2) 621-629 2001年7月  

Identifying and removing intruder states in multireference Moller-Plesset perturbation theory 

JOURNAL OF CHEMICAL PHYSICS 114(9) 3913-3918 2001年3月  

On the performance of diagrammatic complete active space perturbation theory 

JOURNAL OF CHEMICAL PHYSICS 113(18) 7773-7778 2000年11月  

Theoretical study of the electronic ground state of iron(II) porphine. II 

JOURNAL OF CHEMICAL PHYSICS 111(9) 3837-3845 1999年9月  

Theoretical study of the Q and B bands of free-base, magnesium, and zinc porphyrins, and their derivatives 

JOURNAL OF PHYSICAL CHEMISTRY A 103(12) 1894-1904 1999年3月