Multimode quantum dynamics using Gaussian wavepackets: The Gaussian-based multiconfiguration time-dependent Hartree (G-MCTDH) method applied to the absorption spectrum of pyrazine I Burghardt, K Giri, GA Worth The Journal of chemical physics 129 (17), 2008 | 204 | 2008 |
Studies on the interactions of 5-R-3-(2-pyridyl)-1, 2, 4-triazines with arynes: inverse demand aza-Diels–Alder reaction versus aryne-mediated domino process DS Kopchuk, IL Nikonov, AF Khasanov, K Giri, S Santra, IS Kovalev, ... Organic & Biomolecular Chemistry 16 (28), 5119-5135, 2018 | 67 | 2018 |
The QUANTICS Package GA Worth, K Giri, GW Richings, I Burghardt, MH Beck, A Jäckle, HD Meyer University of Birmingham: Birmingham, UK, 2015 | 65 | 2015 |
Solvent-free synthesis of 5-(aryl/alkyl) amino-1, 2, 4-triazines and α-arylamino-2, 2′-bipyridines with greener prospects DS Kopchuk, NV Chepchugov, IS Kovalev, S Santra, M Rahman, K Giri, ... RSC advances 7 (16), 9610-9619, 2017 | 50 | 2017 |
Extended cavity pyrene-based iptycenes for the turn-off fluorescence detection of RDX and common nitroaromatic explosives VNCONC Albert F. Khasanov,a Dmitry S. Kopchuk,ab Igor S. Kovalev,a Olga S ... New J. Chem, 2017 | 35 | 2017 |
3-Cyano-2-azaanthracene-based “push-pull” fluorophores: A one-step preparation from 5-cyano-1, 2, 4-triazines and 2, 3-dehydronaphthalene, generated in situ DS Kopchuk, NV Chepchugov, OS Taniya, AF Khasanov, K Giri, ... Tetrahedron letters 57 (50), 5639-5643, 2016 | 35 | 2016 |
A full-dimensional coupled-surface study of the photodissociation dynamics of ammonia using the multiconfiguration time-dependent Hartree method K Giri, E Chapman, CS Sanz, G Worth The Journal of chemical physics 135 (4), 2011 | 31 | 2011 |
Dissociative Double Ionization of CO2: Dynamics, Energy Levels, and Lifetime V Sharma, B Bapat, J Mondal, M Hochlaf, K Giri, N Sathyamurthy The Journal of Physical Chemistry A 111 (41), 10205-10211, 2007 | 30 | 2007 |
Ground and excited states of the monomer and dimer of certain carboxylic acids U Lourderaj, K Giri, N Sathyamurthy The Journal of Physical Chemistry A 110 (8), 2709-2717, 2006 | 29 | 2006 |
Three Dimensional Quantum Dynamics of (H-, H2) and Its Isotopic Variants AN Panda, K Giri, N Sathyamurthy The Journal of Physical Chemistry A 109 (10), 2057-2061, 2005 | 28 | 2005 |
1-Hydroxypyrene-based micelle-forming sensors for the visual detection of RDX/TNG/PETN-based bomb plots in water IS Kovalev, OS Taniya, DS Kopchuk, K Giri, A Mukherjee, S Santra, ... New Journal of Chemistry 42 (24), 19864-19871, 2018 | 18 | 2018 |
Rotational excitation in (H−, H2) collisions: a quantum mechanical study K Giri, N Sathyamurthy Journal of Physics B: Atomic, Molecular and Optical Physics 39 (20), 4123, 2006 | 15 | 2006 |
Collision-induced dissociation in (He, H2+(v = 0–2; j = 0–3)) system: A time-dependent quantum mechanical investigation S Kolakkandy, K Giri, N Sathyamurthy The Journal of Chemical Physics 136 (24), 2012 | 14 | 2012 |
Influence of Reagent Rotation on (H-, D2) and (D-, H2) Collisions: A Quantum Mechanical Study K Giri, N Sathyamurthy The Journal of Physical Chemistry A 110 (51), 13843-13849, 2006 | 13 | 2006 |
Synthesis and photophysics of new unsymmetrically substituted 5, 5′-diaryl-2, 2′-bypiridine-based “push-pull” fluorophores ES Starnovskaya, DS Kopchuk, AF Khasanov, OS Tanya, S Santra, K Giri, ... Dyes and Pigments 162, 324-330, 2019 | 12 | 2019 |
Shtaitz YaK, Starnovskaya ES, Khalymbadzha IA, Drokin RA, Ulomsky EN, Santra S, Zyryanov GV, Rusinov VL, Chupakhin ON AP Krinochkin, DS Kopchuk, K Giri A PASE Approach towards (Adamantyl-1)-, Alkyl-and (Het) Aryl-Substituted [1 …, 2018 | 12 | 2018 |
Quantum dynamics of (H−, HD) collisions at low energies K Giri, N Sathyamurthy Chemical physics letters 444 (1-3), 23-27, 2007 | 12 | 2007 |
HeH+ Collisions with H2: Rotationally Inelastic Cross Sections and Rate Coefficients from Quantum Dynamics at Interstellar Temperatures K Giri, L González-Sánchez, R Biswas, E Yurtsever, FA Gianturco, ... The Journal of Physical Chemistry A 126 (14), 2244-2261, 2022 | 11 | 2022 |
Energy-transfer quantum dynamics of HeH+ with He atoms: Rotationally inelastic cross sections and rate coefficients FA Gianturco, K Giri, L Gonzalez-Sanchez, E Yurtsever, N Sathyamurthy, ... The Journal of Chemical Physics 154 (5), 2021 | 10 | 2021 |
Supported-Pd catalyzed tandem approach for N-arylbenzamides synthesis AK Sharma, D Bhattacherjee, N Sharma, K Giri, P Das Molecular Catalysis 516, 111948, 2021 | 9 | 2021 |