화학공학소재연구정보센터
검색결과 : 3건
No. Article
1 A Systematic Comparison of Molecular-Properties Obtained Using Hartree-Fock, a Hybrid Hartree-Fock Density-Functional-Theory, and Coupled-Cluster Methods
Oliphant N, Bartlett RJ
Journal of Chemical Physics, 100(9), 6550, 1994
2 Property Evaluation Using the Hartree-Fock-Density-Functional-Theory Method - An Efficient Formalism for First-Order and 2nd-Order Properties
Sekino H, Oliphant N, Bartlett RJ
Journal of Chemical Physics, 101(9), 7788, 1994
3 Theoretical Determination of Charge-Transfer and Ligand-Field Transition Energies for FeCl4- Using the Eom-CCSD Method
Oliphant N, Bartlett RJ
Journal of the American Chemical Society, 116(9), 4091, 1994