| 1 |
Accelerated Distributed Nesterov Gradient Descent
Qu GN, Li N
IEEE Transactions on Automatic Control, 65(6), 2566, 2020 |
| 2 |
Fast arbitrary order moments and arbitrary precision solution of the general rate model of column liquid chromatography with linear isotherm
Leweke S, von Lieres E
Computers & Chemical Engineering, 84, 350, 2016 |
| 3 |
Generalized integral-screening for efficient calculations of nonlinear optical properties of large molecules
Ruud K, Jonsson D, Norman P, Agren H, Saue T, Jensen HJA, Dahle P, Helgaker T
Journal of Chemical Physics, 108(19), 7973, 1998 |
| 4 |
Single crystal polarized spectroscopy of manganese superoxide dismutase and electronic structure of the active site metal complex
Whittaker MM, Ekberg CA, Edwards RA, Baker EN, Jameson GB, Whittaker JW
Journal of Physical Chemistry B, 102(23), 4668, 1998 |
| 5 |
Linear Scaling Conjugate-Gradient Density-Matrix Search as an Alternative to Diagonalization for First Principles Electronic-Structure Calculations
Millam JM, Scuseria GE
Journal of Chemical Physics, 106(13), 5569, 1997 |
| 6 |
The Role of Energy Denominators in Self-Consistent-Field (SCF) Calculations for Open-Shell Systems
Kollmar C
Journal of Chemical Physics, 105(18), 8204, 1996 |
| 7 |
Vibrational and Geometric Structures of Nb3C2 and Nb3C2+ from Pulsed-Field Ionization Zero Electron Kinetic-Energy Photoelectron-Spectra and Density-Functional Calculations
Yang DS, Zgierski MZ, Berces A, Hackett PA, Roy PN, Martinez A, Carrington T, Salahub DR, Fournier R, Pang T, Chen CF
Journal of Chemical Physics, 105(24), 10663, 1996 |
| 8 |
Harmonic Vibrational Frequencies and Force-Constants of M(Co)(5)Cx (M=cr, Mo, W X=o, S, Se) - The Performance of Density-Functional Theory and the Influence of Relativistic Effects
Berces A
Journal of Physical Chemistry, 100(41), 16538, 1996 |
| 9 |
Orbital-Based Direct Inversion in the Iterative Subspace for the Generalized Valence-Bond Method
Ionova IV, Carter EA
Journal of Chemical Physics, 102(3), 1251, 1995 |
| 10 |
The Choice of a Zeroth-Order Hamiltonian for 2nd-Order Perturbation-Theory with a Complete Active Space Self-Consistent-Field Reference Function
Dyall KG
Journal of Chemical Physics, 102(12), 4909, 1995 |
