Result Number | Material Type | Add to My Shelf Action | Record Details and Options |
---|---|---|---|
11 |
Material Type: Artigo
|
On mean-field limits and quantitative estimates with a large class of singular kernels: Application to the Patlak–Keller–Segel modelBresch, Didier ; Jabin, Pierre-Emmanuel ; Wang, ZhenfuComptes rendus. Mathématique, 2019-09, Vol.357 (9), p.708-720 [Periódico revisado por pares]Texto completo disponível |
|
12 |
Material Type: Artigo
|
Gaussian approximation potentials: A brief tutorial introductionBartok, Albert P ; Csanyi, GáborInternational journal of quantum chemistry, 2015-08, Vol.115 (16), p.1051-1057 [Periódico revisado por pares]Hoboken: Blackwell Publishing LtdTexto completo disponível |
|
13 |
Material Type: Artigo
|
Crystal structure representations for machine learning models of formation energiesFaber, Felix ; Lindmaa, Alexander ; von Lilienfeld, O. Anatole ; Armiento, RickardInternational journal of quantum chemistry, 2015-08, Vol.115 (16), p.1094-1101 [Periódico revisado por pares]Hoboken: Blackwell Publishing LtdTexto completo disponível |
|
14 |
Material Type: Artigo
|
TD-DFT benchmarks: A reviewLaurent, Adèle D. ; Jacquemin, DenisInternational journal of quantum chemistry, 2013-09, Vol.113 (17), p.2019-2039 [Periódico revisado por pares]Hoboken: Blackwell Publishing LtdTexto completo disponível |
|
15 |
Material Type: Artigo
|
Structure‐function relationships of starch componentsVamadevan, Varatharajan ; Bertoft, EricDie Stärke, 2015-01, Vol.67 (1-2), p.55-68 [Periódico revisado por pares]Weinheim: Verlag ChemieTexto completo disponível |
|
16 |
Material Type: Artigo
|
Adaptive machine learning framework to accelerate ab initio molecular dynamicsBotu, Venkatesh ; Ramprasad, RampiInternational journal of quantum chemistry, 2015-08, Vol.115 (16), p.1074-1083 [Periódico revisado por pares]Hoboken: Blackwell Publishing LtdTexto completo disponível |
|
17 |
Material Type: Artigo
|
Tensor product methods and entanglement optimization for ab initio quantum chemistrySzalay, Szilárd ; Pfeffer, Max ; Murg, Valentin ; Barcza, Gergely ; Verstraete, Frank ; Schneider, Reinhold ; Legeza, ÖrsInternational journal of quantum chemistry, 2015-10, Vol.115 (19), p.1342-1391 [Periódico revisado por pares]Hoboken: Blackwell Publishing LtdTexto completo disponível |
|
18 |
Material Type: Artigo
|
Machine learning for quantum mechanics in a nutshellRupp, MatthiasInternational journal of quantum chemistry, 2015-08, Vol.115 (16), p.1058-1073 [Periódico revisado por pares]Hoboken: Blackwell Publishing LtdTexto completo disponível |
|
19 |
Material Type: Artigo
|
The Bravyi-Kitaev transformation: Properties and applicationsTranter, Andrew ; Sofia, Sarah ; Seeley, Jake ; Kaicher, Michael ; McClean, Jarrod ; Babbush, Ryan ; Coveney, Peter V. ; Mintert, Florian ; Wilhelm, Frank ; Love, Peter J.International journal of quantum chemistry, 2015-10, Vol.115 (19), p.1431-1441 [Periódico revisado por pares]Hoboken: Blackwell Publishing LtdTexto completo disponível |
|
20 |
Material Type: Artigo
|
Intrinsic reaction coordinate: Calculation, bifurcation, and automated searchMaeda, Satoshi ; Harabuchi, Yu ; Ono, Yuriko ; Taketsugu, Tetsuya ; Morokuma, KeijiInternational journal of quantum chemistry, 2015-03, Vol.115 (5), p.258-269 [Periódico revisado por pares]Hoboken: Blackwell Publishing LtdTexto completo disponível |