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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
8802019
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
1742011
Accurate analytic potentials for Li2(X-state) and Li2(A-state) from 2 to 90 Å, 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
158*2009
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
1572023
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
1272015
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
1212019
Quantum factorization of 56153 with only 4 qubits
NS Dattani, N Bryans
arXiv preprint arXiv:1411.6758, 2014
992014
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
972020
Pegasus: The second connectivity graph for large-scale quantum annealing hardware
N Dattani, S Szalay, N Chancellor
arXiv preprint arXiv:1901.07636, 2019
872019
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
77*2012
Numerical Feynman integrals with physically inspired interpolation: Faster convergence and significant reduction of computational cost
NS Dattani
AIP advances 2 (1), 2012
70*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
652021
Quadratization in discrete optimization and quantum mechanics
N Dattani
arXiv preprint arXiv:1901.04405, 2019
612019
Opportunities for fundamental physics research with radioactive molecules
G Arrowsmith-Kron, M Athanasakis-Kaklamanakis, M Au, J Ballof, ...
Reports on progress in physics 87 (8), 084301, 2024
542024
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
51*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
49*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
452013
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
432015
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
412016
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
392015
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