Search Results

There are 9481 results for: content related to: Asymptotic structure of the Kohn–Sham effective potential at metal surfaces

  1. Exact electronic properties in the classically forbidden region of a metal surface

    International Journal of Quantum Chemistry

    Volume 104, Issue 6, 2005, Pages: 929–945, Zhixin Qian and Viraht Sahni

    Article first published online : 12 MAY 2005, DOI: 10.1002/qua.20609

  2. Exchange potentials at a metal surface

    International Journal of Quantum Chemistry

    Volume 56, Issue S29, 25 February/4 March 1995, Pages: 31–40, Alexander Solomatin and Viraht Sahni

    Article first published online : 21 SEP 2004, DOI: 10.1002/qua.560560805

  3. The work formalism of electronic structure

    International Journal of Quantum Chemistry

    Volume 56, Issue 4, 15 November 1995, Pages: 265–283, Viraht Sahni

    Article first published online : 21 SEP 2004, DOI: 10.1002/qua.560560412

  4. Quantum-Mechanical interpretation of the local many-body potential of density-functional theory

    International Journal of Quantum Chemistry

    Volume 38, Issue S24, 17/24 March 1990, Pages: 569–584, Viraht Sahni and Manoj K. Harbola

    Article first published online : 19 OCT 2004, DOI: 10.1002/qua.560382456

  5. The gradient expansion approximation for exchange: A physical prespective

    International Journal of Quantum Chemistry

    Volume 44, Issue S26, 14/21 March 1992, Pages: 333–345, Marlina Slamet and Viraht Sahni

    Article first published online : 19 OCT 2004, DOI: 10.1002/qua.560440829

  6. Derivation and reinterpretation of approximations in Schröudinger and Kohn–;Sham theory via a hierarchy within the work formalism

    International Journal of Quantum Chemistry

    Volume 53, Issue 6, 15 March 1995, Pages: 591–606, Viraht Sahni

    Article first published online : 21 SEP 2004, DOI: 10.1002/qua.560530603

  7. Density functional theory via density matrices

    International Journal of Quantum Chemistry

    Volume 56, Issue S29, 25 February/4 March 1995, Pages: 137–144, N. H. March

    Article first published online : 21 SEP 2004, DOI: 10.1002/qua.560560814

  8. Electron correlations in Kohn–Sham exchange-only theory

    International Journal of Quantum Chemistry

    Volume 71, Issue 6, 1999, Pages: 473–480, Viraht Sahni and Marlina Slamet

    Article first published online : 3 JAN 1999, DOI: 10.1002/(SICI)1097-461X(1999)71:6<473::AID-QUA4>3.0.CO;2-V

  9. Analysis of the density-gradient-expansion approximation for the exchange-correlation energy of density-functional theory

    International Journal of Quantum Chemistry

    Volume 40, Issue S25, 1991, Pages: 235–248, Marlina Slamet and Viraht Sahni

    Article first published online : 19 OCT 2004, DOI: 10.1002/qua.560400824

  10. Analytical properties of the Kohn–Sham theory exchange and correlation energy and potential via quantal density functional theory

    International Journal of Quantum Chemistry

    Volume 80, Issue 4-5, 2000, Pages: 555–566, Zhixin Qian and Viraht Sahni

    Article first published online : 20 OCT 2000, DOI: 10.1002/1097-461X(2000)80:4/5<555::AID-QUA4>3.0.CO;2-N

  11. Analytical asymptotic structure of the Pauli, Coulomb, and correlation–kinetic components of the Kohn–Sham theory exchange–correlation potential in atoms

    International Journal of Quantum Chemistry

    Volume 70, Issue 4-5, 1998, Pages: 671–680, Zhixin Qian and Viraht Sahni

    Article first published online : 7 DEC 1998, DOI: 10.1002/(SICI)1097-461X(1998)70:4/5<671::AID-QUA13>3.0.CO;2-5

  12. Is there supernova evidence for dark energy metamorphosis?

    Monthly Notices of the Royal Astronomical Society

    Volume 354, Issue 1, October 2004, Pages: 275–291, Ujjaini Alam, Varun Sahni, Tarun Deep Saini and A. A. Starobinsky

    Article first published online : 13 SEP 2004, DOI: 10.1111/j.1365-2966.2004.08189.x

  13. Comment on “Density and physical current density functional theory”

    International Journal of Quantum Chemistry

    Volume 114, Issue 3, 5 February 2014, Pages: 233–236, Xiao-Yin Pan and Viraht Sahni

    Article first published online : 26 AUG 2013, DOI: 10.1002/qua.24532

  14. Smoothing supernova data to reconstruct the expansion history of the Universe and its age

    Monthly Notices of the Royal Astronomical Society

    Volume 366, Issue 3, March 2006, Pages: 1081–1095, Arman Shafieloo, Ujjaini Alam, Varun Sahni and Alexei A. Starobinsky

    Article first published online : 19 JAN 2006, DOI: 10.1111/j.1365-2966.2005.09911.x

  15. Morphology of the supercluster–void network in ΛCDM cosmology

    Monthly Notices of the Royal Astronomical Society

    Volume 353, Issue 1, September 2004, Pages: 162–178, Sergei F. Shandarin, Jatush V. Sheth and Varun Sahni

    Article first published online : 2 JUL 2004, DOI: 10.1111/j.1365-2966.2004.08060.x

  16. Proof of finiteness of Kohn–Sham theory electron interaction potential at the nucleus of atoms

    International Journal of Quantum Chemistry

    Volume 79, Issue 4, 2000, Pages: 205–208, Zhixin Qian and Viraht Sahni

    Article first published online : 17 JUL 2000, DOI: 10.1002/1097-461X(2000)79:4<205::AID-QUA1>3.0.CO;2-Y

  17. First-order correlation-kinetic contribution to Kohn–Sham exchange charge density function in atoms, using quantal density functional theory approach

    International Journal of Quantum Chemistry

    Volume 101, Issue 3, 2005, Pages: 231–238, K. D. Sen and F. Javier Luque

    Article first published online : 13 OCT 2004, DOI: 10.1002/qua.20262

  18. Normalization and Fermi–Coulomb and Coulomb hole sum rules for approximate wave functions

    International Journal of Quantum Chemistry

    Volume 107, Issue 4, 2007, Pages: 816–823, Xiao-Yin Pan, Viraht Sahni and Lou Massa

    Article first published online : 4 OCT 2006, DOI: 10.1002/qua.21177

  19. On Ehrenfest's theorem

    International Journal of Quantum Chemistry

    Volume 97, Issue 6, 2004, Pages: 953–960, Viraht Sahni

    Article first published online : 23 DEC 2003, DOI: 10.1002/qua.10824

  20. Modified Slater potential and its application to the ground-states and excited-states of atomic systems

    International Journal of Quantum Chemistry

    Volume 90, Issue 1, 2002, Pages: 327–333, Manoj K. Harbola and K. D. Sen

    Article first published online : 9 MAY 2002, DOI: 10.1002/qua.943