Niri Govind

Dikutip oleh

	Semua	Sejak 2020
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109 artikel

19 artikel

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Karol KowalskiPacific Northwest National LaboratoryEmail yang diverifikasi di pnnl.gov
Eric BylaskaChemical Physics Theory Team, Pacific Northwest National LaboratoryEmail yang diverifikasi di pnnl.gov
Marat ValievPacific Northwest National LaboratoryEmail yang diverifikasi di pnl.gov
Edoardo ApràPacific Northwest National LaboratoryEmail yang diverifikasi di pnnl.gov
Bert de JongLawrence Berkeley National LaboratoryEmail yang diverifikasi di lbl.gov
Hubertus Johannes Jacobus van DamBrookhaven National LaboratoryEmail yang diverifikasi di bnl.gov
Emily A. CarterSenior Strategic Advisor for Sustainability Science, PPPL and Gerhard R. Andlinger Professor inEmail yang diverifikasi di princeton.edu
Amity AndersenScientist, PNNLEmail yang diverifikasi di pnnl.gov
Kenneth LopataLouisiana State University, Department of ChemistryEmail yang diverifikasi di lsu.edu
Munira KhalilProfessor, Department of Chemistry, University of WashingtonEmail yang diverifikasi di uw.edu
Theresa L. WindusDistinguished Professor of Chemistry at Iowa State University; Senior Scientist at Ames National LabEmail yang diverifikasi di iastate.edu
Shaul MukamelDistinguished Professor of Chemistry and of Physics and Astronomy, University of California, IrvineEmail yang diverifikasi di uci.edu
George FitzgeraldUniversal Display CorporationEmail yang diverifikasi di oled.com
Christopher J. CramerUL Research InstitutesEmail yang diverifikasi di ul.org
Jochen AutschbachProfessor of Chemistry, University at Buffalo, State University of New YorkEmail yang diverifikasi di buffalo.edu
Bo PengComputational Scientist, Pacific Northwest National LibraryEmail yang diverifikasi di pnnl.gov
DUNYOU WANGShandong Normal UniversityEmail yang diverifikasi di sdnu.edu.cn
Yu ZhangAmes National LaboratoryEmail yang diverifikasi di ameslab.gov
Gregory SchenterPacific Northwest National LaboratoryEmail yang diverifikasi di pnnl.gov
Robert W. SchoenleinSLAC National Accelerator LaboratoryEmail yang diverifikasi di slac.stanford.edu

Ikuti

Niri Govind

Nama lainnyaNiranjan Govind, N. Govind

Physicist, Pacific Northwest National Laboratory

Email yang diverifikasi di pnnl.gov - Beranda

Electronic Structure Theory X-ray Spectroscopy Ultrafast Dynamics Chemical Physics


Judul Urutkan menurut kutipan Urutkan menurut tahun Urutkan menurut judul	Dikutip oleh Dikutip oleh	Tahun
NWChem: a comprehensive and scalable open-source solution for large scale molecular simulations M Valiev, EJ Bylaska, N Govind, K Kowalski, TP Straatsma, HJJ Van Dam, ... Computer Physics Communications 181 (9), 1477-1489, 2010	4560	2010
A generalized synchronous transit method for transition state location N Govind, M Petersen, G Fitzgerald, D King-Smith, J Andzelm Computational materials science 28 (2), 250-258, 2003	1290	2003
NWChem: Past, present, and future E Aprà, EJ Bylaska, WA de Jong, N Govind, K Kowalski, TP Straatsma, ... Journal of Chemical Physics 152 (18), 2020	675	2020
NWChem, a computational chemistry package for parallel computers, Version 5.1 EJ Bylaska, WA De Jong, N Govind, K Kowalski, TP Straatsma, M Valiev, ... Pacific Northwest National Laboratory, Richland, Washington 99352, 0999, 2007	608	2007
Orbital-free kinetic-energy density functionals with a density-dependent kernel YA Wang, N Govind, EA Carter Physical Review B 60 (24), 16350, 1999	350	1999
Quasiparticle Spectra from a Nonempirical Optimally Tuned Range-Separated Hybrid Density Functional S Refaely-Abramson, S Sharifzadeh, N Govind, J Autschbach, JB Neaton, ... Physical review letters 109 (22), 226405, 2012	321	2012
Modeling fast electron dynamics with real-time time-dependent density functional theory: Application to small molecules and chromophores K Lopata, N Govind Journal of chemical theory and computation 7 (5), 1344-1355, 2011	306	2011
Electronic-structure calculations by first-principles density-based embedding of explicitly correlated systems N Govind, YA Wang, EA Carter The Journal of chemical physics 110 (16), 7677-7688, 1999	302	1999
Linear-response and real-time time-dependent density functional theory studies of core-level near-edge X-ray absorption K Lopata, BE Van Kuiken, M Khalil, N Govind Journal of chemical theory and computation 8 (9), 3284-3292, 2012	266	2012
Molecular structure and stability of dissolved lithium polysulfide species M Vijayakumar, N Govind, E Walter, SD Burton, A Shukla, A Devaraj, ... Physical Chemistry Chemical Physics 16 (22), 10923-10932, 2014	262	2014
Accurate ab initio energetics of extended systems via explicit correlation embedded in a density functional environment N Govind, YA Wang, AJR Da Silva, EA Carter Chemical physics letters 295 (1-2), 129-134, 1998	258	1998
Quantitatively probing the Al distribution in zeolites A Vjunov, JL Fulton, T Huthwelker, S Pin, D Mei, GK Schenter, N Govind, ... Journal of the American Chemical Society 136 (23), 8296-8306, 2014	246	2014
Real-time time-dependent electronic structure theory X Li, N Govind, C Isborn, AE DePrince III, K Lopata Chemical Reviews 120 (18), 9951-9993, 2020	219	2020
Orbital-free kinetic-energy functionals for the nearly free electron gas YA Wang, N Govind, EA Carter Physical Review B 58 (20), 13465, 1998	219	1998
VQE method: a short survey and recent developments DA Fedorov, B Peng, N Govind, Y Alexeev Materials Theory 6 (1), 2, 2022	217	2022
Periodic density functional embedding theory for complete active space self-consistent field and configuration interaction calculations: Ground and excited states T Klüner, N Govind, YA Wang, EA Carter The Journal of chemical physics 116 (1), 42-54, 2002	208	2002
NWChem E Apra, EJ Bylaska, WA de Jong, N Govind, K Kowalski, TP Straatsma, ... American Institute of Physics, 2020	199	2020
Curvature and frontier orbital energies in density functional theory T Stein, J Autschbach, N Govind, L Kronik, R Baer The journal of physical chemistry letters 3 (24), 3740-3744, 2012	190	2012
Nanotube-based gas sensors–Role of structural defects J Andzelm, N Govind, A Maiti Chemical Physics Letters 421 (1-3), 58-62, 2006	171	2006
Prediction of electronic excited states of adsorbates on metal surfaces from first principles T Klüner, N Govind, YA Wang, EA Carter Physical review letters 86 (26), 5954, 2001	162	2001

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