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Naughton HR, Alexandrou MA, Oakley TH, Cardinale BJ. 2015. Phylogenetic distance does not predict competition in green algal communities. Ecosphere. 6:art116.

Natarajan ARaju, Van der Ven A. 2020. Linking electronic structure calculations to generalized stacking fault energies in multicomponent alloys. arXiv preprint arXiv:2001.06912.

Natarajan ARaju, Van der Ven A. 2019. Machine-learning the configurational energy of multicomponent crystalline solids. npj Computational Materials. 4:56.

Natarajan ARaju, Van der Ven A. 2017. First-principles investigation of phase stability in the Mg-Sc binary alloy. Physical Review B. 95:214107.

Natarajan ARaju, Van der Ven A. 2017. A unified description of ordering in HCP Mg-RE alloys. Acta Materialia. 124:620–632.

Natarajan ARaju, Van der Ven A. 2019. Connecting the Simpler Structures to Topologically Close-Packed Phases. Physical review letters. 121:255701.

Nakayama H, Schneider JA, Faust M, Wang H, de Alaniz JRead, Chabinyc ML. 2020. A new family of liquid and solid guanidine-based n-type dopants for solution-processed perovskite solar cells. Materials Chemistry Frontiers.

M

Murray M.M, Griffin-Krone M., Bernstein S.L, Baumketner A., Condron M.M, Lazo N.D, Teplow D.B, Wyttenbach T., Shea J.-E., Bowers J.MT. 2009. Amyloid-beta-Protein: Experiment and Theory on the 21-30 Fragment. Phys. Chem. B. 113:6041.

Mullen RGotchy, Shea J-E, Peters B. 2014. Transmission coefficients, committors, and solvent coordinates in ion-pair dissociation. Journal of Chemical Theory and Computation.

Mullen RGotchy, Shea J-E, Peters B. 2015. Easy Transition Path Sampling Methods: Flexible Length Aimless Shooting and Permutation Shooting. Journal of Chemical Theory and Computation.

Mullen RGotchy, Shea J-E, Peters B. 2014. Communication: An existence test for dividing surfaces without recrossing. The Journal of Chemical Physics. 140:041104.

Mu S, Peelaers H, Van de Walle CG. 2019. Ab initio study of enhanced thermal conductivity in ordered AlGaO3 alloys. Applied Physics Letters. 115:242103.

Mu S, Wang M, Peelaers H, Van de Walle CG. 2020. First-principles surface energies for monoclinic Ga2O3 and Al2O3 and consequences for cracking of (Al x Ga1- x) 2O3. APL Materials. 8:091105.

Motrunich O.I. 2005. Variational study of triangular lattice spin-1/2 model with ring exchanges and spin liquid state in kappa-(ET)2 Cu2 (CN)3. Phys. Rev. B. 72:45105.

Motrunich O.I. 2006. Orbital magnetic field effects in spin liquid with spinon Fermi sea: Possible application to kappa-(ET)2 Cu2 (CN)3. Phys. Rev. B. 73:155115.

Mostovoy M, Scaramucci A, Spaldin NA, Delaney KT. 2010. Microscopic theory of temperature-dependent magnetoelectric effect in Cr2O3. Phys. Rev. Lett.. 105:87202.

Mostovoy M, Scaramucci A, Spaldin NA, Delaney KT. 2010. Temperature-Dependent Magnetoelectric Effect from First Principles. Phys. Rev. Lett.. 105:87202.

Moses PG, Janotti A, Franchini C, Kresse G, Van de Walle CG. 2016. Donor defects and small polarons on the TiO2 (110) surface. Journal of Applied Physics. 119:181503.

Moses PGeorg, Van de Walle CG. 2010. Band bowing and band alignment in InGaN alloys. Appl. Phys. Lett.. 96:21908.

Morriss-Andrews A, Shea J-E. 2015. Computational Studies of Protein Aggregation: Methods and Applications. Annual review of physical chemistry. 66:643–666.

Morriss-Andrews A, Shea J-E. 2014. Simulations of Protein Aggregation: Insights from Atomistic and Coarse-Grained Models. The Journal of Physical Chemistry Letters.

Morriss-Andrews A, Brown FLeon Halet, Shea J-E. 2014. A Coarse-Grained Model for Peptide Aggregation on a Membrane Surface. The Journal of Physical Chemistry B.

Morgan EE, Mao L, Teicher SML, Wu G, Seshadri R. 2020. Tunable Perovskite-Derived Bismuth Halides: Cs3Bi2 (Cl1–x I x) 9. Inorganic Chemistry.

Monroe JI, M Shell S. 2019. Decoding signatures of structure, bulk thermodynamics, and solvation in three-body angle distributions of rigid water models. The Journal of chemical physics. 151:094501.

Momida H, Cockayne E, Umezawa N, Ohno T. 2010. Computational study of the dielectric properties of [La,Sc]2O3 solid solutions. Journal of Applied Physics. 107:74104.

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Acknowledgements

Please acknowledge the CSC in publications and presentations if you are using our facilities computing resources in your research.

Use was made of computational facilities purchased with funds from the National Science Foundation (CNS-1725797) and administered by the Center for Scientific Computing (CSC). The CSC is supported by the California NanoSystems Institute and the Materials Research Science and Engineering Center (MRSEC; NSF DMR 1720256) at UC Santa Barbara.