AN MCSCF STUDY OF THE LOW-LYING STATES OF TRANS-BUTADIENE

[1] CI STUDY OF GEOMETRICAL RELAXATION IN THE EXCITED-STATES OF BUTADIENE - ENERGY SURFACES AND PROPERTIES FOR SIMULTANEOUS TORSION AND ELONGATION OF ONE DOUBLE-BOND [J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1982, 104 (25) : 6900 - 6907

[2] NONPLANARITY IN HEXAFLUOROBUTADIENE AS REVEALED BY PHOTOELECTRON AND OPTICAL SPECTROSCOPY [J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1970, 92 (19) : 5550 - &

[3] ALL-VALENCE-ELECTRON CI TREATMENT OF ELECTRONIC-SPECTRUM OF TRANS-BUTADIENE [J]. CHEMICAL PHYSICS LETTERS, 1976, 44 (02) : 385 - 393

[4] CHRISTENSEN RL, 1976, J PHYS CHEM, V80, P2179

[5] EQUILIBRIUM GEOMETRY AND DYNAMICS OF THE VALENCE EXCITED-STATES OF 1,3-BUTADIENE [J]. JOURNAL OF PHYSICAL CHEMISTRY, 1983, 87 (06) : 924 - 932

[6] Dupuis M., 1980, NRCC SOFTWARE CATALO, V1

[7] EXPERIMENTAL CONFIRMATION OF THE DIPOLE FORBIDDEN CHARACTER OF THE LOWEST EXCITED SINGLET-STATE IN 1,3,5,7-OCTATETRAENE [J]. JOURNAL OF CHEMICAL PHYSICS, 1979, 70 (01) : 593 - 594

[8] FRANCK-CONDON ANALYSIS OF THE 11AG-]11BU ABSORPTION IN LINEAR POLYENES WITH 2 THROUGH 6 DOUBLE-BONDS [J]. JOURNAL OF CHEMICAL PHYSICS, 1981, 75 (08) : 3765 - 3769

[9] SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .I. USE OF GAUSSIAN EXPANSIONS OF SLATER-TYPE ATOMIC ORBITALS [J]. JOURNAL OF CHEMICAL PHYSICS, 1969, 51 (06) : 2657 - +

[10] FRANCK-CONDON ANALYSIS OF THE 1 1AG--]1 1BU+ TRANSITION OF 1,3-BUTADIENE FROM ABSORPTION AND RAMAN INTENSITIES [J]. JOURNAL OF CHEMICAL PHYSICS, 1983, 78 (06) : 2915 - 2927

[1] CI STUDY OF GEOMETRICAL RELAXATION IN THE EXCITED-STATES OF BUTADIENE - ENERGY SURFACES AND PROPERTIES FOR SIMULTANEOUS TORSION AND ELONGATION OF ONE DOUBLE-BOND [J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1982, 104 (25) : 6900 - 6907

[2] NONPLANARITY IN HEXAFLUOROBUTADIENE AS REVEALED BY PHOTOELECTRON AND OPTICAL SPECTROSCOPY [J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1970, 92 (19) : 5550 - &

[3] ALL-VALENCE-ELECTRON CI TREATMENT OF ELECTRONIC-SPECTRUM OF TRANS-BUTADIENE [J]. CHEMICAL PHYSICS LETTERS, 1976, 44 (02) : 385 - 393

[4] CHRISTENSEN RL, 1976, J PHYS CHEM, V80, P2179

[5] EQUILIBRIUM GEOMETRY AND DYNAMICS OF THE VALENCE EXCITED-STATES OF 1,3-BUTADIENE [J]. JOURNAL OF PHYSICAL CHEMISTRY, 1983, 87 (06) : 924 - 932

[6] Dupuis M., 1980, NRCC SOFTWARE CATALO, V1

[7] EXPERIMENTAL CONFIRMATION OF THE DIPOLE FORBIDDEN CHARACTER OF THE LOWEST EXCITED SINGLET-STATE IN 1,3,5,7-OCTATETRAENE [J]. JOURNAL OF CHEMICAL PHYSICS, 1979, 70 (01) : 593 - 594

[8] FRANCK-CONDON ANALYSIS OF THE 11AG-]11BU ABSORPTION IN LINEAR POLYENES WITH 2 THROUGH 6 DOUBLE-BONDS [J]. JOURNAL OF CHEMICAL PHYSICS, 1981, 75 (08) : 3765 - 3769

[9] SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .I. USE OF GAUSSIAN EXPANSIONS OF SLATER-TYPE ATOMIC ORBITALS [J]. JOURNAL OF CHEMICAL PHYSICS, 1969, 51 (06) : 2657 - +

[10] FRANCK-CONDON ANALYSIS OF THE 1 1AG--]1 1BU+ TRANSITION OF 1,3-BUTADIENE FROM ABSORPTION AND RAMAN INTENSITIES [J]. JOURNAL OF CHEMICAL PHYSICS, 1983, 78 (06) : 2915 - 2927