Items where Author is "Whitehead, M. A."

Article

Kishner, S. ; Whitehead, M. A. ; Gopinathan, M. S. (1978) Localized molecular orbitals for dinitrogen dioxide, dinitrogen trioxide, and dinitrogen tetroxide Journal of American Chemical Society, 100 (5). pp. 1365-1371. ISSN 0002-7863

Foti, Aniko E. ; Smith Jr., Vedene H. ; Kishner, S. ; Gopinathan, M. S. ; Whitehead, M. A. (1978) Comparison of SCF-Xα-SW and CNDO/BW calculations on S₄N₄H₄ and F₄S₄N₄ Molecular Physics, 35 (1). pp. 111 - 127. ISSN 0026-8976

Desmier, P. E. ; Whitehead, M. A. ; Bogdanovic, R. ; Gopinathan, M. S. (1977) Fermi contact interaction and spin density distribution in the Mn² ion: an X_α study using theoretical exchange parameters Molecular Physics, 33 (5). pp. 1457-1462. ISSN 0026-8976

Gopinathan, M. S. ; Whitehead, M. A. ; Bogdanovic, R. (1976) The Fermi hole and the exchange parameter in X_α theory Physical Review A, 14 (1). pp. 1-10. ISSN 1050-2947

Gopinathan, M. S. ; Whitehead, M. A. (1976) Hellmann-Feynman and virial theorems and the total energy of molecules Journal of Chemical Physics, 65 (1). pp. 196-200. ISSN 0021-9606

Bogdanovic, R. ; Whitehead, M. A. ; Gopinathan, M. S. (1976) Factorization of the evolution operator for a spin-orbit coupled system in an external magnetic field for an arbitrary L and S = ½ Canadian Journal of Physics, 54 (23). pp. 2295-2305. ISSN 0008-4204

Gopinathan, M. S. ; Whitehead, M. A. (1975) The electronic structure and localized molecular orbitals in S₄N₄ by the CNDO/BW theory Canadian Journal Of Chemistry, 53 (9). pp. 1343-1347. ISSN 0008-4042

Gopinathan, M. S. ; Whitehead, M. A. ; Coulson, C. A. ; Carruthers, J. R. ; Rollett, J. S. (1974) A reinvestigation of the crystal and molecular structure of hexachloroborazine. A correction Acta Crystallographica Section B: Structural Science, 30 (6). p. 1650. ISSN 0108-7681

Gopinathan, M. S. ; Whitehead, M. A. ; Coulson, C. A. ; Carruthers, J. R. ; Rollett, J. S. (1974) Structural crystallography and crystal chemistry Acta Crystallographica Section B: Structural Science, 30 (3). pp. 731-737. ISSN 0108-7681

Gopinathan, M. S. ; Whitehead, M. A. ; Coulson, C. A. ; Carruthers, J. R. ; Rollett, J. S. (1974) A reinvestigation of the crystal and molecular structure of hexachloroborazine Acta Crystallographica Section B: Structural Science, 30 (3). pp. 731-737. ISSN 0108-7681