IRIS
ZEN, ANDREA
 Distribuzione geografica
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Continente #
NA - Nord America 272
EU - Europa 155
AS - Asia 26
OC - Oceania 2
AF - Africa 1
Continente sconosciuto - Info sul continente non disponibili 1
Totale 457
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Nazione #
US - Stati Uniti d'America 270
IT - Italia 118
CN - Cina 13
GB - Regno Unito 13
NL - Olanda 10
IN - India 6
BE - Belgio 5
DE - Germania 3
AU - Australia 2
CA - Canada 2
HK - Hong Kong 2
IE - Irlanda 2
SG - Singapore 2
CH - Svizzera 1
EU - Europa 1
FI - Finlandia 1
GH - Ghana 1
HR - Croazia 1
ID - Indonesia 1
IS - Islanda 1
JP - Giappone 1
KR - Corea 1
Totale 457
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Città #
Chandler 53
Millbury 38
Rome 31
Grugliasco 27
Lawrence 27
Des Moines 20
Naples 20
Ashburn 18
Aprilia 17
Amsterdam 10
Nanjing 7
Wilmington 7
Bitonto 5
Boston 5
Brussels 5
Pune 5
Woodbridge 5
Hebei 4
London 4
Manchester 3
Redwood City 3
Bloomsbury 2
Dublin 2
Hong Kong 2
Marigliano 2
Milan 2
Napoli 2
Ottawa 2
Vajont 2
York 2
Capodrise 1
Changsha 1
Davis 1
Fairfield 1
Freiburg im Breisgau 1
Haywards Heath 1
Kamampa 1
Kronberg 1
Lappeenranta 1
Los Angeles 1
Maletto 1
Montecorvino Pugliano 1
New Delhi 1
Norwalk 1
Reykjavik 1
San Costantino Calabro 1
Seoul 1
Tianjin 1
Tokyo 1
Zagreb 1
Zurich 1
Totale 353
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Nome #
Boosting the accuracy and speed of quantum Monte Carlo: Size consistency and time step 37
Fast and accurate quantum Monte Carlo for molecular crystals 37
Physisorption of Water on Graphene: Subchemical Accuracy from Many-Body Electronic Structure Methods 28
DMC-ICE13: ambient and high pressure polymorphs of ice from Diffusion Monte Carlo and Density Functional Theory 24
Properties of the water to boron nitride interaction: From zero to two dimensions with benchmark accuracy 22
Hydration of NH4+ in Water: Bifurcated Hydrogen Bonding Structures and Fast Rotational Dynamics 22
Evidence for stable square ice from quantum Monte Carlo 19
Toward accurate adsorption energetics on clay surfaces 19
Interaction between water and carbon nanostructures: How good are current density functional approximations? 19
TurboRVB: A many-body toolkit for ab initio electronic simulations by quantum Monte Carlo 19
Beyond GGA total energies for solids and surfaces 14
A new scheme for fixed node diffusion quantum Monte Carlo with pseudopotentials: Improving reproducibility and reducing the trial-wave-function bias 14
Ab initio molecular dynamics simulation of liquid water by quantum Monte Carlo 14
Materials and Molecular Modeling at the Exascale 13
Interactions between large molecules pose a puzzle for reference quantum mechanical methods 13
The New Resonating Valence Bond Method for Ab-Initio Electronic Simulations 13
Ice formation on kaolinite: Insights from molecular dynamics simulations 12
Crystal Nucleation in Liquids: Open Questions and Future Challenges in Molecular Dynamics Simulations 12
Correspondences between low-energy modes in enzymes: Dynamics-based alignment of enzymatic functional families 12
Small- and large-scale conformational changes of adenylate kinase: A molecular dynamics study of the subdomain motion and mechanics 12
Mechanisms of adsorbing hydrogen gas on metal decorated graphene 12
Communication: Truncated non-bonded potentials can yield unphysical behavior in molecular dynamics simulations of interfaces 10
Long-Range Ionic and Short-Range Hydration Effects Govern Strongly Anisotropic Clay Nanoparticle Interactions 9
Percolation transition in a dynamically clustered network 9
Defect-Dependent Corrugation in Graphene 8
Ab initio molecular dynamics with noisy forces: Validating the quantum Monte Carlo approach with benchmark calculations of molecular vibrational properties 8
Using dynamics-based comparisons to predict nucleic acid binding sites in proteins: An application to OB-fold domains 8
Optimized structure and vibrational properties by error affected potential energy surfaces 8
Molecular properties by quantum Monte Carlo: An investigation on the role of the wave function ansatz and the basis set in the water molecule 8
Finite-temperature electronic simulations without the Born-Oppenheimer constraint 7
Quantum monte carlo treatment of the charge transfer and diradical electronic character in a retinal chromophore minimal model 6
Unraveling H2 chemisorption and physisorption on metal decorated graphene using quantum Monte Carlo 5
Static and dynamical correlation in diradical molecules by quantum monte carlo using the jastrow antisymmetrized geminal power ansatz 5
Properties of reactive oxygen species by quantum Monte Carlo 5
Comparing interfacial dynamics in protein-protein complexes: An elastic network approach 5
General embedded cluster protocol for accurate modeling of oxygen vacancies in metal-oxides 5
Quantifying the Impact of Halogenation on Intermolecular Interactions and Binding Modes of Aromatic Molecules 3
Many-Body Methods for Surface Chemistry Come of Age: Achieving Consensus with Experiments 3
The first-principles phase diagram of monolayer nanoconfined water 3
Mesoscale Simulations Reveal How Salt Influences Clay Particles Agglomeration in Aqueous Dispersions 1
Totale 503
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Categoria #
all - tutte 3.133
article - articoli 0
book - libri 0
conference - conferenze 0
curatela - curatele 0
other - altro 0
patent - brevetti 0
selected - selezionate 0
volume - volumi 0
Totale 3.133
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Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2018/20191 0 0 0 0 0 0 0 0 0 0 1 0
2019/202022 13 0 1 3 3 0 0 0 0 0 2 0
2020/202188 0 0 0 0 1 53 0 31 1 2 0 0
2021/202299 0 0 2 0 0 2 2 5 3 2 17 66
2022/2023168 27 8 3 20 11 24 5 17 23 8 16 6
2023/2024105 8 31 23 3 4 20 6 5 0 5 0 0
Totale 503