A comparison of models for calculating nuclear magnetic resonance shielding tensors von Cheeseman, James R., Trucks, Gary W., Keith, Todd A., Frisch, Michael J.

Volltext

Highly correlated systems. Excitation energies of first row transition metals Sc-Cu von KRISHNAN RAGHAVACHARI, TRUCKS, G. W

Volltext

Ideal hydrogen termination of the Si (111) surface von HIGASHI, G. S, CHABAL, Y. J, TRUCKS, G. W, RAGHAVACHARI, K

Volltext

Gaussian-1 theory of molecular energies for second-row compounds von CURTISS, L. A, JONES, C, TRUCKS, G. W, RAGHAVACHARI, K, POPLE, J. A

Volltext

Size-consistent Brueckner theory limited to double substitutions von Handy, Nicholas C., Pople, John A., Head-Gordon, Martin, Raghavachari, Krishnan, Trucks, Gary W.

Volltext

Mechanism of HF etching of silicon surfaces : a theoretical understanding of hydrogen passivation von TRUCKS, G. W, RAGHAVACHARI, K, HIGASHI, G. S, CHABAL, Y. J

Volltext

Highly correlated systems: Structure, binding energy and harmonic vibrational frequencies of ozone von Raghavachari, Krishnan, Trucks, Gary W., Pople, John A., Replogle, Eric

Volltext

Vibrational Analysis of the Ground States of Trifluoroacetyl Fluoride and Trifluoroacetyl Chloride von Bent, Gary D, Zerrad, Essaid, Trucks, Gary W, Wiberg, Kenneth B, Taing, Len

Volltext

Two charged particles in a one-dimensional well von Salter, Edward A., Trucks, Gary W., Cyphert, Daniel S.

Volltext

THEORETICAL-STUDY OF SMALL ALUMINUM PHOSPHIDE AND MAGNESIUM SULFIDE CLUSTERS von ALLAHAM, MA, TRUCKS, GW, RAGHAVACHARI, K

Volltext

Highly correlated systems. Ionization energies of first row transition metals Sc―Zn von KRISHNAN RAGHAVACHARI, TRUCKS, G. W

Volltext

Theory and implementation of the MBPT density matrix. An application to one-electron properties von Trucks, Gary W., Salter, E.A., Sosa, Carlos, Bartlett, Rodney J.

Volltext

Selection of the reduced virtual space for correlated calculations. An application to the energy and dipole moment of H2O von SOSA, C, GEERTSEN, J, TRUCKS, G. W, BARTLETT, R. J, FRANZ, J. A

Volltext

Gradient theory applied to the Brueckner doubles method von KOBAYASHI, R, HANDY, N. C, AMOS, R. D, TRUCKS, G. W, FRISCH, M. J, POPLE, J. A

Volltext

The unitary coupled-cluster approach and molecular properties. Applications of the UCC(4) method von Watts, John D., Trucks, Gary W., Bartlett, Rodney J.

Volltext

Highly correlated systems. Structure and harmonic force field of F2O2 von KRISHNAN RAGHAVACHARI, TRUCKS, G. W

Volltext

A 5TH-ORDER METHOD FOR 2-ELECTRON INTEGRAL DERIVATIVE TRANSFORMATION von HEADGORDON, M, TRUCKS, GW, FRISCH, MJ

Volltext

Theory and application of MBPT(3) gradients: The density approach von Salter, E.A., Trucks, Gary W., Fitzgerald, George, Bartlett, Rodney J.

Volltext

Analytical MBPT(4) gradients von Trucks, Gary W., Watts, John D., Salter, E.A., Bartlett, Rodney J.

Volltext

Convergence of the coupled-cluster singles, doubles and triples method von Trucks, Gary W., Noga, Jozef, Bartlett, Rodney J.

Volltext