화학공학소재연구정보센터
검색결과 : 13건
No. Article
1 Origins of structural and electronic transitions in disordered silicon
Deringer VL, Bernstein N, Csanyi G, Ben Mahmoud C, Ceriotti M, Wilson M, Drabold DA, Elliott SR
Nature, 589(7840), 59, 2021
2 Effect of Anisotropic Confinement on Electronic Structure and Dynamics of Band Edge Excitons in Inorganic Perovskite Nanowires
Folie BD, Tan JA, Huang JM, Sercel PC, Delor M, Lai ML, Lyons JL, Bernstein N, Efros AL, Yang PD, Ginsberg NS
Journal of Physical Chemistry A, 124(9), 1867, 2020
3 Modeling the Phase-Change Memory Material, Ge2Sb2Te5, with a Machine-Learned Interatomic Potential
Mocanu FC, Konstantinou K, Lee TH, Bernstein N, Deringer VL, Csanyi G, Elliott SR
Journal of Physical Chemistry B, 122(38), 8998, 2018
4 Bright triplet excitons in caesium lead halide perovskites
Becker MA, Vaxenburg R, Nedelcu G, Sercel PC, Shabaev A, Mehl MJ, Michopoulos JG, Lambrakos SG, Bernstein N, Lyons JL, Stoferle T, Mahrt RF, Kovalenko MV, Norris DJ, Raino G, Efros AL
Nature, 553(7687), 189, 2018
5 In-situ measurements of lattice expansion related to defect generation during flash sintering
Lebrun JM, Hellberg CS, Jha SK, Kriven WM, Steveson A, Seymour KC, Bernstein N, Erwin SC, Raj R
Journal of the American Ceramic Society, 100(11), 4965, 2017
6 Adsorption-Induced Deformation of Hierarchically Structured Mesoporous Silica Effect of Pore-Level Anisotropy
Balzer C, Waag AM, Gehret S, Reichenauer G, Putz F, Husing N, Paris O, Bernstein N, Gor GY, Neimark AV
Langmuir, 33(22), 5592, 2017
7 Adsorption-Induced Surface Stresses of the Water/Quartz Interface: Ab Initio Molecular Dynamics Study
Gor GY, Bernstein N
Langmuir, 32(21), 5259, 2016
8 Tests of an Adaptive QM/MM Calculation on Free Energy Profiles of Chemical Reactions in Solution
Varnai C, Bernstein N, Mones L, Csanyi G
Journal of Physical Chemistry B, 117(40), 12202, 2013
9 Simulations of Nanocylinders Self-Assembled from Cyclic beta-Tripeptides
Bernstein N, Kulp JL, Cato MA, Clark TD
Journal of Physical Chemistry A, 114(44), 11948, 2010
10 A first-principles density-functional calculation of the electronic and vibrational structure of the key melanin monomers
Powell BJ, Baruah T, Bernstein N, Brake K, McKenzie RH, Meredith P, Pederson MR
Journal of Chemical Physics, 120(18), 8608, 2004