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R

Rajat K. Chaudhuri

department of science & technology (india)

29H指数
165论文数
3.0K被引数
收录论文 39
发表时间
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A Fock space coupled cluster based probing of the single- and double-ionization profiles for the poly-cyclic aromatic hydrocarbons and conjugated polyenes
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2021-03-15
err1
PREAI
errChaudhuri, Rajat K.; Chattopadhyay, Sudip
err分享
err收藏
Taming the excited states of butadiene, hexatriene, and octatetraene using state specific multireference perturbation theory with density functional theory orbitals
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2020-06-22
err11
PREAI
errManna, Shovan; Chaudhuri, Rajat K.; Chattopadhyay, Sudip
err分享
err收藏
Fock-space multireference coupled cluster calculations of Auger energies of noble gas elements using relativistic spinors
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2019-08-20
err0
PREAI
errChaudhuri, Rajat K.; Chattopadhyay, Sudip
err分享
err收藏
A simplified account of the correlation effects to bond breaking processes: The Brillouin-Wigner perturbation theory using a multireference formulation对键断裂过程的相关效应的简化说明: 使用多参考公式的布里渊-维格纳微扰理论
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2019-08-13
err7
PREAI
errManna, Shovan; Ray, Suvonil Sinha; Chattopadhyay, Sudip; Chaudhuri, Rajat K.
err分享
err收藏
A confinement induced spectroscopic study of noble gas atoms using equation of motion architecture: Encapsulation within fullerene's voids
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2017-07-20
err9
PREAI
errChaudhuri, Supriya K.; Chaudhuri, Rajat K.; Mukherjee, Prasanta K.; Chattopadhyay, Sudip
err分享
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Improved virtual orbitals in state specific multireference perturbation theory for prototypes of quasidegenerate electronic structure
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2017-02-13
err15
PREAI
errRay, Suvonil Sinha; Ghosh, Pradipta; Chaudhuri, Rajat K.; Chattopadhyay, Sudip
err分享
err收藏
Communication: Viewing the ground and excited electronic structures of platinum and its ion through the window of relativistic coupled cluster method
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2017-01-07
err3
errOAAI
errRay, Suvonil Sinha; Chaudhuri, Rajat K.; Chattopadhyay, Sudip
err分享
err收藏
Relativistic state-specific multireference coupled cluster theory description for bond-breaking energy surfaces
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2016-09-23
err12
PREAI
errGhosh, Anirban; Chaudhuri, Rajat K.; Chattopadhyay, Sudip
err分享
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State-specific multireference perturbation theory: development and present status
errWILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE
IF27
err2016-02-05
err37
PREAI
errChattopadhyay, Sudip; Chaudhuri, Rajat K.; Mahapatra, Uttam Sinha; Ghosh, Anirban; Ray, Suvonil Sinha
err分享
err收藏
Relativistic state-specific multireference perturbation theory incorporating improved virtual orbitals: Application to the ground state single-bond dissociation
errJOURNAL OF COMPUTATIONAL CHEMISTRY
IF4.8
err2015-08-13
err9
PREAI
errGhosh, Anirban; Chaudhuri, Rajat K.; Chattopadhyay, Sudip; Mahapatra, Uttam Sinha
err分享
err收藏
State-Specific Multireference Perturbation Theory with Improved Virtual Orbitals: Taming the Ground State of F2, Be2, and N2
errJOURNAL OF COMPUTATIONAL CHEMISTRY
IF4.8
err2015-03-05
err37
PREAI
errChattopadhyay, Sudip; Chaudhuri, Rajat K.; Mahapatra, Uttam Sinha
err分享
err收藏
Application of an efficient multireference approach to free-base porphin and metalloporphyrins: Ground, excited, and positive ion states
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2011-08-26
err20
PREAI
errChaudhuri, Rajat K.; Freed, Karl F.; Chattopadhyay, Sudip; Mahapatra, Uttam Sinha
err分享
err收藏
Second-Order State-Specific Multireference Moller Plesset Perturbation Theory: Application to Energy Surfaces of Diimide, Ethylene, Butadiene, and Cyclobutadiene
errJOURNAL OF COMPUTATIONAL CHEMISTRY
IF4.8
err2010-12-06
err14
PREAI
errMahapatra, Uttam Sinha; Chattopadhyay, Sudip; Chaudhuri, Rajat K.
err分享
err收藏
Study of the Ground State Dissociation of Diatomic Molecular Systems Using State-Specific Multireference Perturbation Theory: A Brillouin-Wigner Scheme
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2010-02-12
err24
PREAI
errMahapatra, Uttam Sinha; Chattopadhyay, Sudip; Chaudhuri, Rajat K.
err分享
err收藏
Molecular applications of analytical gradient approach for the improved virtual orbital-complete active space configuration interaction method
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2010-01-20
err14
PREAI
errChaudhuri, Rajat K.; Chattopadhyay, Sudip; Mahapatra, Uttam Sinha; Freed, Karl F.
err分享
err收藏
Application of state-specific multireference Moller-Plesset perturbation theory to nonsinglet states
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2009-01-05
err35
PREAI
errMahapatra, Uttam Sinha; Chattopadhyay, Sudip; Chaudhuri, Rajat K.
err分享
err收藏
Application of improved virtual orbital based multireference methods to N2, LiF, and C4H6 systems改进的基于虚拟轨道的多参考方法在N2，LiF和C4H6系统中的应用
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2008-12-29
err26
PREAI
errChattopadhyay, Sudip; Chaudhuri, Rajat K.; Mahapatra, Uttam Sinha
err分享
err收藏
Reappraisal of cis effect in 1,2-dihaloethenes:: An improved virtual orbital multireference approach
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2008-08-08
err24
PREAI
errChaudhuri, Rajat K.; Hammond, Jeff R.; Freed, Karl F.; Chattopadhyay, Sudip; Mahapatra, Uttam Sinha
err分享
err收藏
Improved virtual orbital multireference Moller-Plesset study of the ground and excited electronic states of protonated acetylene, C2H3+
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2008-08-05
err10
PREAI
errChaudhuri, Rajat K.; Freed, Karl F.
err分享
err收藏
Molecular applications of state-specific multireference perturbation theory to HF, H2O, H2S, C2, and N2 molecules
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2008-07-10
err48
PREAI
errMahapatra, Uttam Sinha; Chattopadhyay, Sudip; Chaudhuri, Rajat K.
err分享
err收藏

研究方向

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合作学者
合作期刊
K
Kimihiko Hirao
H 指数: 81 · 论文数: 735
K
Karl F. Freed
H 指数: 80 · 论文数: 735
P
Piotr Piecuch
H 指数: 68 · 论文数: 288
D
Debashis Mukherjee
H 指数: 54 · 论文数: 301
K
Karol Kowalski
H 指数: 53 · 论文数: 329
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