화학공학소재연구정보센터
검색결과 : 26건
No. Article
1 Quantum gate generation by T-sampling stabilisation
Silveira HB, da Silva PSP, Rouchon P
International Journal of Control, 87(6), 1227, 2014
2 Relativistic effects in silicon chemistry : Are the experimental heats of formation of the silicon atom and SiH4 compatible?
Collins CL, Grev RS
Journal of Chemical Physics, 108(13), 5465, 1998
3 Single-root multireference Brillouin-Wigner coupled-cluster theory : Applicability to the F-2 molecule
Masik J, Hubac I, Mach P
Journal of Chemical Physics, 108(16), 6571, 1998
4 A comparison between the CISD[TQ] wave function and other highly correlated methods : Molecular geometry and harmonic vibrational frequencies of MgH2
Tschumper GS, Schaefer HF
Journal of Chemical Physics, 108(18), 7511, 1998
5 Energies and analytic gradients for a coupled-cluster doubles model using variational Brueckner orbitals : Application to symmetry breaking in O-4(+)
Sherrill CD, Krylov AI, Byrd EFC, Head-Gordon M
Journal of Chemical Physics, 109(11), 4171, 1998
6 The Hydroperoxyl Radical Dimer - Triplet Ring or Singlet String
Fermann JT, Hoffman BC, Tschumper GS, Schaefer HF
Journal of Chemical Physics, 106(12), 5102, 1997
7 Revision of the Experimental Electron-Affinity of BO
Rienstra JC, Schaefer HF
Journal of Chemical Physics, 106(19), 8278, 1997
8 Protonated High-Energy Density Materials - N-4 Tetrahedron and N-8 Octahedron
Leininger ML, Vanhuis TJ, Schaefer HF
Journal of Physical Chemistry A, 101(24), 4460, 1997
9 Matrix-Elements of U(2N) Generators in a Multishell Spin-Orbit Basis .1. General Formalism
Burton PJ, Gould MD
Journal of Chemical Physics, 104(13), 5112, 1996
10 Multiconfiguration Self-Consistent-Field Procedure Employing Linear Combination of Atomic-Electron Distributions
Tenno S, Iwata S
Journal of Chemical Physics, 105(9), 3604, 1996