Pablo J. Bruna

The ground state of the CN+ ion: a multi-reference Ci study

Pablo J. Bruna, Sigrid D. Peyerimhoff, Robert J. Buenker · Chemical Physics Letters · 1980 · 312 citations

Cn+ Ion, Engineering, Ion Exchange +12

Ab initio CI study of the stability and electronic spectrum of the HOCl molecule

Gerhard Hirsch, Pablo J. Bruna, Sigrid D. Peyerimhoff et al. · Chemical Physics Letters · 1977 · 223 citations

Physics, Hocl Molecule, Natural Sciences +6

Non-adiabatic coupling matrix elements <Ψz|∂/∂Q|Ψβ> for large CI wavefunctions

Gerhard Hirsch, Pablo J. Bruna, Robert J. Buenker et al. · Chemical Physics · 1980 · 187 citations

Spectral Theory, Quantum Science, Quantum Dynamic +9

Theoretical prediction of the potential curves for the lowest-lying states of the isovalent diatomics CN+, Si2, SiC, CP+, and SiN+ using the <i>a</i> <i>b</i> <i>i</i> <i>n</i> <i>i</i> <i>t</i> <i>i</i> <i>o</i> MRD-CI method

Pablo J. Bruna, Sigrid D. Peyerimhoff, Robert J. Buenker · The Journal of Chemical Physics · 1980 · 153 citations

Engineering, Ci Calculations, Theoretical Inorganic Chemistry +20

Theoretical prediction of the potential curves for the lowest-lying states of the C2+ molecular ion

Carlo Petrongolo, Pablo J. Bruna, Sigrid D. Peyerimhoff et al. · The Journal of Chemical Physics · 1981 · 92 citations · Full text

Engineering, Nuclear Physics, Computational Chemistry +17