Wang Jin, Tosatti Erio
International School for Advanced Studies (SISSA), Trieste 34136, Italy.
International Centre for Theoretical Physics, Trieste 34151, Italy.
Proc Natl Acad Sci U S A. 2024 Dec 3;121(49):e2418390121. doi: 10.1073/pnas.2418390121. Epub 2024 Nov 27.
The physics of membranes, a classic subject, acquires new momentum from two-dimensional (2D) materials multilayers. This work reports the surprising results emerged during a theoretical study of equilibrium geometry of bilayers as freestanding membranes. While ordinary membranes are prone to buckle around compressive impurities, we predict that all 2D material freestanding bilayers universally undergo, even if impurity-free, a spontaneous out-of-plane buckling. The moiré network nodes here play the role of impurities, the dislocations that join them giving rise to a stress pattern, purely shear in homobilayers and mixed compressive/shear in heterobilayers. That intrinsic stress is, theory and simulations show, generally capable to cause all freestanding 2D bilayers to undergo distortive bucklings with large amplitudes and a rich predicted phase transition scenario. Realistic simulations predict quantitative parameters expected for these phenomena as expected in heterobilayers such as graphene/hBN, [Formula: see text] heterobilayers, and for twisted homobilayers such as graphene, hBN, [Formula: see text]. Buckling then entails a variety of predicted consequences. Mechanically, a critical drop of bending stiffness is expected at all buckling transitions. Thermally, the average buckling corrugation decreases with temperature, with buckling-unbuckling phase transitions expected in some cases, and the buckled state often persisting even above room temperature. Buckling will be suppressed by deposition on hard attractive substrates, and survives in reduced form on soft ones. Frictional, electronic, and other associated phenomena are also highlighted. The universality and richness of these predicted phenomena strongly encourages an experimental search, which is possible but still missing.
膜物理作为一个经典学科,正从二维(2D)材料多层膜中获得新的发展动力。这项工作报告了在对双层自由站立膜的平衡几何结构进行理论研究过程中出现的惊人结果。虽然普通膜容易在压缩杂质周围发生屈曲,但我们预测,所有二维材料自由站立双层膜即使没有杂质,也普遍会发生自发的面外屈曲。这里的莫尔网络节点起到杂质的作用,连接它们的位错会产生一种应力模式,在同质双层膜中纯粹是剪切应力,在异质双层膜中是压缩/剪切混合应力。理论和模拟表明,这种内应力通常能够使所有自由站立的二维双层膜发生大振幅的扭曲屈曲,并呈现出丰富的预测相变情景。实际模拟预测了这些现象在诸如石墨烯/hBN等异质双层膜以及诸如石墨烯、hBN等扭曲同质双层膜中预期的定量参数。屈曲会带来各种预测结果。在力学方面,预计在所有屈曲转变时弯曲刚度会有临界下降。在热学方面,平均屈曲波纹随温度降低,在某些情况下预计会有屈曲 - 解屈曲相变,并且屈曲状态通常甚至在室温以上仍会持续。在硬的吸引性衬底上沉积会抑制屈曲,而在软衬底上屈曲会以减弱的形式存在。还强调了摩擦、电子和其他相关现象。这些预测现象的普遍性和丰富性有力地鼓励了实验探索,这是可行的,但仍未开展。