Results 211 to 220 of about 830,992 (228)

An atomic orbital-based formulation of analytical gradients and nonadiabatic coupling vector elements for the state-averaged complete active space self-consistent field method on graphical processing units

Journal of Chemical Physics, 2015
Edward G Hohenstein, Nathan Luehr, Todd J Martinez   +2 more
exaly  

Complete Metric Spaces

1964
openaire   +1 more source

Graphical Representations of Complete Metric Spaces

Journal of the London Mathematical Society, 1970
openaire   +2 more sources

Analytic first derivatives of floating occupation molecular orbital-complete active space configuration interaction on graphical processing units

Journal of Chemical Physics, 2015
Edward G Hohenstein, Chenchen Song, Nathan Luehr   +2 more
exaly  

Complete metric spaces

2003
openaire   +1 more source

The Treatment of Wounds With Especial Reference to the Value of the Blood Clot in the Management of Dead Space: IV.Operations for Carcinoma of the Breast

Ca-A Cancer Journal for Clinicians, 1973
exaly  

A direct-compatible formulation of the coupled perturbed complete active space self-consistent field equations on graphical processing units

Journal of Chemical Physics, 2017
B Scott Fales, Edward G Hohenstein, Benjamin G Levine   +2 more
exaly  

Non-Hodgkin's Lymphoma of the Spinal Cord

Ca-A Cancer Journal for Clinicians, 1980
exaly  

Analytic formulation of derivative coupling vectors for complete active space configuration interaction wavefunctions with floating occupation molecular orbitals

Journal of Chemical Physics, 2016
Edward G Hohenstein
exaly  

Second‐order perturbation theory with a complete active space self‐consistent field reference function

Journal of Chemical Physics, 1992
exaly