Nike Dattani
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OpenMolcas: From source code to insight
I Fdez. Galván, M Vacher, A Alavi, C Angeli, F Aquilante, J Autschbach, ...
Journal of chemical theory and computation 15 (11), 5925-5964, 2019
General approach to quantum dynamics using a variational master equation: Application to phonon-damped Rabi rotations in quantum dots
DPS McCutcheon, NS Dattani, EM Gauger, BW Lovett, A Nazir
Physical Review B 84 (11), 119903, 2011
Accurate analytic potentials for Li2(X-state) and Li2(A-state) from 2 to 90 Ĺ, and the radiative lifetime of Li(2p)
RJ Le Roy, NS Dattani, JA Coxon, AJ Ross, P Crozet, C Linton
The Journal of Chemical Physics 131 (20), 204309, 2009
Why quantum coherence is not important in the Fenna-Matthews-Olsen Complex
DM Wilkins, NS Dattani
Journal of Chemical Theory and Computation 11 (7), 3411–3419, 2015
I Fdez, M Galván, A Vacher, C Alavi, F Angeli, J Aquilante, JJ Autschbach, ...
J. Chem. Theory Comput. 15, 5925, 2019
The electronic complexity of the ground-state of the FeMo cofactor of nitrogenase as relevant to quantum simulations
Z Li, J Li, NS Dattani, CJ Umrigar, GK Chan
The Journal of chemical physics 150 (2), 2019
Quantum factorization of 56153 with only 4 qubits
NS Dattani, N Bryans
arXiv preprint arXiv:1411.6758, 2014
NECI: N-Electron Configuration Interaction with an emphasis on state-of-the-art stochastic methods
K Guther, RJ Anderson, NS Blunt, NA Bogdanov, D Cleland, N Dattani, ...
The Journal of chemical physics 153 (3), 2020
The OpenMolcas Web: A Community-Driven Approach to Advancing Computational Chemistry
G Li Manni, I Fdez. Galván, A Alavi, F Aleotti, F Aquilante, J Autschbach, ...
Journal of chemical theory and computation 19 (20), 6933-6991, 2023
Pegasus: The second connectivity graph for large-scale quantum annealing hardware
N Dattani, S Szalay, N Chancellor
arXiv preprint arXiv:1901.07636, 2019
Optimal representation of the bath response function & fast calculation of influence functional coefficients in open quantum systems with bathfit 1
NS Dattani, DM Wilkins, FA Pollock
arXiv preprint arXiv:1205.4651, 2012
Numerical Feynman integrals with physically inspired interpolation: Faster convergence and significant reduction of computational cost
NS Dattani
AIP advances 2 (1), 2012
The GW miracle in many-body perturbation theory for the ionization potential of molecules
F Bruneval, N Dattani, MJ van Setten
Frontiers in chemistry 9, 749779, 2021
Quadratization in discrete optimization and quantum mechanics
N Dattani
arXiv preprint arXiv:1901.04405, 2019
A DPF data analysis yields accurate analytic potentials for Li2(a-state) and Li2(c-state) that incorporate 3-state mixing near the c-state asymptote
NS Dattani, RJ Le Roy
Journal of Molecular Spectroscopy, 2011
A DPF data analysis yields accurate analytic potentials for Li (a Σ) and Li (1 Σ) that incorporate 3-state mixing near the state asymptote
NS Dattani, RJ Le Roy
Journal of Molecular Spectroscopy 268, 199-210, 2011
High-resolution photoassociation spectroscopy of the 6Li2 1 Σ state
M Semczuk, X Li, W Gunton, M Haw, NS Dattani, J Witz, AK Mills, ...
Physical Review A 87 (5), 052505, 2013
Mapping the space of genomic signatures
L Kari, KA Hill, AS Sayem, R Karamichalis, N Bryans, K Davis, NS Dattani
PloS one 10 (5), e0119815, 2015
An investigation into inter-and intragenomic variations of graphic genomic signatures
R Karamichalis, L Kari, S Konstantinidis, S Kopecki
BMC bioinformatics 16, 1-22, 2015
Towards a feasible implementation of quantum neural networks using quantum dots
MV Altaisky, NN Zolnikova, NE Kaputkina, VA Krylov, YE Lozovik, ...
Applied Physics Letters 108 (10), 2016
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