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Electron Impact Catalytic Dissociation: Two‐Bond Breaking by a Low‐Energy Catalytic Electron
D Davis, VP Vysotskiy, Y Sajeev, LS Cederbaum
Angewandte Chemie 50 (18), 4119-4122, 2011
672011
Communication: Continuum remover-complex absorbing potential: Efficient removal of the nonphysical stabilization points
Y Sajeev, V Vysotskiy, LS Cederbaum, N Moiseyev
The Journal of chemical physics 131 (21), 211102, 2009
552009
A One‐Step Four‐Bond‐Breaking Reaction Catalyzed by an Electron
D Davis, VP Vysotskiy, Y Sajeev, LS Cederbaum
Angewandte Chemie International Edition 51 (32), 8003-8007, 2012
522012
Theory of autoionization and photoionization in two-electron spherical quantum dots
Y Sajeev, N Moiseyev
Physical Review B 78 (7), 075316, 2008
512008
Analytically continued Fock space multireference coupled-cluster theory: Application to the Πg2 shape resonance in e-N2 scattering
Y Sajeev, R Santra, S Pal
The Journal of chemical physics 122 (23), 2005
492005
Coupled cluster methods for autoionisation resonances
Y Sajeev, A Ghosh, N Vaval, S Pal
International Reviews in Physical Chemistry 33 (3), 397-425, 2014
482014
Reflection-free complex absorbing potential for electronic structure calculations: Feshbach-type autoionization resonances of molecules
Y Sajeev, N Moiseyev
The Journal of chemical physics 127 (3), 2007
452007
Correlated complex independent particle potential for calculating electronic resonances
Y Sajeev, R Santra, S Pal
The Journal of chemical physics 123 (20), 2005
422005
A general formalism of the Fock space multireference coupled cluster method for investigating molecular electronic resonances
Y Sajeev, S Pal
Molecular Physics 103 (15-16), 2267-2275, 2005
352005
Reflection-free complex absorbing potential for electronic structure calculations: Feshbach type autoionization resonance of Helium
Y Sajeev, M Sindelka, N Moiseyev
Chemical physics 329 (1-3), 307-312, 2006
342006
Real-valued continuum remover potential: An improved L2-stabilization method for the chemistry of electronic resonance states
Y Sajeev
Chemical Physics Letters 587, 105-112, 2013
332013
Communication: Hund’s multiplicity rule: From atoms to quantum dots
Y Sajeev, M Sindelka, N Moiseyev
The Journal of chemical physics 128 (6), 061101, 2008
302008
Fock space multireference coupled cluster calculations based on an underlying bivariational self-consistent field on Auger and shape resonances
Y Sajeev, MK Mishra, N Vaval, S Pal
The Journal of chemical physics 120 (1), 67-72, 2004
282004
Formation of CO2 from formic acid through catalytic electron channel
D Davis, S Kundu, VS Prabhudesai, Y Sajeev, E Krishnakumar
The Journal of Chemical Physics 149 (6), 2018
272018
Optimization of nonlinear optical properties by substituent position, geometry and symmetry of the molecule: An ab initio study
D Davis, K Sreekumar, Y Sajeev, S Pal
The Journal of Physical Chemistry B 109 (29), 14093-14101, 2005
242005
Communication: Low-energy-electron induced permanently reactive CO 2 molecules
D Davis, Y Sajeev
Physical Chemistry Chemical Physics 16 (33), 17408-17411, 2014
192014
Ab-initio complex molecular potential energy surfaces by the back-rotation transformation method
P Balanarayan, Y Sajeev, N Moiseyev
Chemical Physics Letters 524, 84-89, 2012
152012
An Electron Propagator Approach Based on a Multiconfigurational Reference State for the Investigation of Negative-Ion Resonances Using a Complex Absorbing Potential Method
S Das, Y Sajeev, K Samanta
Journal of Chemical Theory and Computation 16 (8), 5024-5034, 2020
132020
Analytically continued Fock space multi-reference coupled-cluster theory: Application to the shape resonance
S Pal, Y Sajeev, N Vaval
Chemical physics 329 (1-3), 283-289, 2006
122006
A Concerted Synchronous [2+ 2] Cycloreversion Repair Catalyzed by Two Electrons
D Davis, KG Bhushan, Y Sajeev, LS Cederbaum
The Journal of Physical Chemistry Letters 9 (24), 6973-6977, 2018
112018
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Articles 1–20