Journals in DBLP

Journal of Computational Chemistry
1996, volume: 17, number: 1

1. Mark A. Spackman
   Potential derived charges using a geodesic point selection scheme. [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 1996, v:17, n:1, pp:1-18 [Journal]
   
2. Iñaki Tuñón, Marilia T. C. Martins-Costa, Claude Millot, Manuel F. Ruiz-López, Jean-Louis Rivail
   A coupled density functional-molecular mechanics Monte Carlo simulation method: The water molecule in liquid water. [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 1996, v:17, n:1, pp:19-29 [Journal]
   
3. Peeter Burk, Ilmar A. Koppel, Ivar Koppel, Lev M. Yagupolskii, Robert W. Taft
   Superacidity of neutral Brfnsted acids in gas phase. [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 1996, v:17, n:1, pp:30-41 [Journal]
   
4. O. Castell, V. M. García, C. Bo, R. Caballol
   Relative stability of the 3A2, 1A2, and 1A1 states of phenylnitrene: A difference-dedicated configuration interaction calculation. [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 1996, v:17, n:1, pp:42-48 [Journal]
   
5. Chunyang Peng, Philippe Y. Ayala, H. Bernhard Schlegel, Michael J. Frisch
   Using redundant internal coordinates to optimize equilibrium geometries and transition states. [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 1996, v:17, n:1, pp:49-56 [Journal]
   
6. Maurizio Cossi, Benedetta Mennucci, Roberto Cammi
   Analytical first derivatives of molecular surfaces with respect to nuclear coordinates. [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 1996, v:17, n:1, pp:57-73 [Journal]
   
7. D. Delfini, C. Nicolini, E. A. Carrara
   Performance analysis of the double-iterated Kalman filter for molecular structure estimation. [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 1996, v:17, n:1, pp:74-86 [Journal]
   
8. Dirk Bakowies, Walter Thiel
   Semiempirical treatment of electrostatic potentials and partial charges in combined quantum mechanical and molecular mechanical approaches. [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 1996, v:17, n:1, pp:87-108 [Journal]
   
9. Ian T. Foster, Jeffrey L. Tilson, Albert F. Wagner, Ron L. Shepard, Robert J. Harrison, Ricky A. Kendall, Rik J. Littlefield
   Toward high-performance computational chemistry: I. Scalable Fock matrix construction algorithms. [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 1996, v:17, n:1, pp:109-123 [Journal]
   
10. Robert J. Harrison, Martyn F. Guest, Ricky A. Kendall, David E. Bernholdt, Adrian T. Wong, Mark Stave, James L. Anchell, Anthony C. Hess, Rik J. Littlefield, George L. Fann, Jarek Nieplocha, Greg S. Thomas, David Elwood, Jeffrey L. Tilson, Ron L. Shepard, Albert F. Wagner, Ian T. Foster, Ewing L. Lusk, Rick Stevens
    Toward high-performance computational chemistry: II. A scalable self-consistent field program. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1996, v:17, n:1, pp:124-132 [Journal]