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Publications by Diptarka Hait
How Accurate Are Static Polarizability Predictions From Density Functional Theory? An Assessment Over 132 Species at Equilibrium Geometry.
Physical Chemistry Chemical Physics
Theoretical Chemistry
Astronomy
Physics
Physical
Communication: xDH Double Hybrid Functionals Can Be Qualitatively Incorrect for Non-Equilibrium Geometries: Dipole Moment Inversion and Barriers to Radical-Radical Association Using XYG3 and XYGJ-OS
Journal of Chemical Physics
Medicine
Theoretical Chemistry
Astronomy
Physics
Physical
Bimolecular Reaction Dynamics in the Phenyl - Silane System: Exploring the Prototype of a Radical Substitution Mechanism
Generalized Single Excitation Configuration Interaction: An Investigation Into the Impact of the Inclusion of Non-Orthogonality on the Calculation of Core-Excited States
What Levels of Coupled Cluster Theory Are Appropriate for Transition Metal Systems? A Study Using Near Exact Quantum Chemical Values for 3d Transition Metal Binary Compounds.
What Levels of Coupled Cluster Theory Are Appropriate for Transition Metal Systems? A Study Using Near Exact Quantum Chemical Values for 3d Transition Metal Binary Compounds.
What Levels of Coupled Cluster Theory Are Appropriate for Transition Metal Systems? A Study Using Near Exact Quantum Chemical Values for 3d Transition Metal Binary Compounds.
Generalized Single Excitation Configuration Interaction: An Investigation Into the Impact of the Inclusion of Non-Orthogonality on the Calculation of Core-Excited States
Bimolecular Reaction Dynamics in the Phenyl - Silane System: Exploring the Prototype of a Radical Substitution Mechanism
