Showing results (91-100 of 129) with videos related to

Sort By:
Pageof 13
The Journal of Chemical Physics|March 25, 2014
Ground state of naphthyl cation: singlet or triplet?Achintya Kumar Dutta, Prashant U Manohar, Nayana Vaval, et al.
The Journal of Physical Chemistry. A|May 26, 2017
Fenton's Reagent Catalyzed Release of Carbon Monooxide from 1,3-Dihydroxy AcetoneTumpa Sadhukhan, Dharitri Das, Pratik Kalekar, et al.
Molecules (Basel, Switzerland)|July 9, 2022
Integration of Ligand-Based and Structure-Based Methods for the Design of Small-Molecule TLR7 AntagonistsSourav Pal, Uddipta Ghosh Dastidar, Trisha Ghosh, et al.
The Journal of Physical Chemistry. A|August 17, 2018
Computational Approach to Unravel the Role of Hydrogen Bonding in the Interaction of NAMI-A with DNA Nucleobases and NucleotidesDharitri Das, Muntazir S Khan, Gayatree Barik, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)|March 12, 2022
The Decisive Role of Spin States and Spin Coupling in Dictating Selective O2 Adsorption in Chromium(II) Metal-Organic FrameworksReshma Jose, Srinivasu Kancharlapalli, Tapan K Ghanty, et al.
The Journal of Chemical Physics|September 3, 2015
Calculation of P,T-odd interaction constant of PbF using Z-vector method in the relativistic coupled-cluster frameworkSudip Sasmal, Himadri Pathak, Malaya K Nayak, et al.
The Journal of Physical Chemistry. A|January 22, 2010
Comparison of the auxiliary density perturbation theory and the noniterative approximation to the coupled perturbed Kohn-Sham method: case study of the polarizabilities of disubstituted azoarene moleculesSapana V Shedge, Javier Carmona-Espíndola, Sourav Pal, et al.
The Journal of Chemical Physics|August 22, 2016
Relativistic equation-of-motion coupled-cluster method using open-shell reference wavefunction: Application to ionization potentialHimadri Pathak, Sudip Sasmal, Malaya K Nayak, et al.
The Journal of Chemical Physics|April 3, 2016
Search for parity and time reversal violating effects in HgH: Relativistic coupled-cluster studySudip Sasmal, Himadri Pathak, Malaya K Nayak, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)|January 31, 2022
The Decisive Role of Spin States and Spin Coupling in Dictating Selective O2 Adsorption in Chromium(II) Metal-Organic FrameworksReshma Jose, Srinivasu Kancharlapalli, Tapan K Ghanty, et al.
Pageof 13