Spin density in first-row atoms from the Hiller-Sucher-Feinberg identity Vitaly A. RassolovDaniel M. Chipman OriginalPaper Pages: 1 - 15
The internal rotational barrier of biphenyl studied with multiconfigurational second-order perturbation theory (CASPT2) Mercedes RubioManuela MerchánEnrique Ortí OriginalPaper Pages: 17 - 29
Different forms of the zeroth-order Hamiltonian in second-order perturbation theory with a complete active space self-consistent field reference function K. Andersson OriginalPaper Pages: 31 - 46
Roothaan-Hartree-Fock wave functions for cations and anions in Slater-type basis sets with doubly even tempered exponents Toshikatsu KogaEri ShibataAjit J. Thakkar OriginalPaper Pages: 47 - 66
Theoretical characterization and many-body expansion analysis of BF3, BCl3, AlF3 and AlCl3 interactions A. S. ShalabiK. A. KamelM. M. Assem OriginalPaper Pages: 73 - 81
A CASPT2 study of the valence and lowest Rydberg electronic states of benzene and phenol Johan LorentzonPer-Åke MalmqvistBjörn O. Roos OriginalPaper Pages: 91 - 108
RECP calculations for reactions of H2 with Pt, Os, Ir, and Re — a systematic comparison Odd GropenMerethe SjøvollKnut Fægri Jr. Erratum Pages: 109 - 110
Roothaan–Hartree–Fock wave functions for cations and anions in Slater-type basis sets with doubly even tempered exponents Toshikatsu KogaEri ShibataAjit J. Thakkar Pages: 47 - 66