Electronic structure, bonding, and ground-state properties of AlB 2-type transition-metal diborides P Vajeeston, P Ravindran, C Ravi, R Asokamani Physical Review B 63 (4), 045115, 2001 | 511 | 2001 |

First-principles study of crystal structure and stability of Al–Mg–Si–(Cu) precipitates C Ravi, C Wolverton Acta materialia 52 (14), 4213-4227, 2004 | 385 | 2004 |

Predicting metastable phase boundaries in Al–Cu alloys from first-principles calculations of free energies: the role of atomic vibrations C Ravi, C Wolverton, V Ozoliņš EPL (Europhysics Letters) 73 (5), 719, 2006 | 72 | 2006 |

Electronic Structure Calculations and Physical Properties of ABX_{2}(A = Cu, Ag; B = Ga, In; X = S, Se, Te) Ternary Chalcopyrite SystemsR Asokamani, RM Amirthakumari, R Rita, C Ravi physica status solidi (b) 213 (2), 349-363, 1999 | 54 | 1999 |

Electronic structure, phase stability, and cohesive properties of Ti 2 X Al (X= N b, V, Zr) C Ravi, P Vajeeston, S Mathijaya, R Asokamani Physical Review B 60 (23), 15683, 1999 | 49 | 1999 |

Thermodynamic stability of oxide phases of Fe–Cr based ODS steels via quantum mechanical calculations R Chinnappan Calphad 45, 188-193, 2014 | 38 | 2014 |

Anharmonic phonons of NaZr 2 (PO 4) 3 studied by Raman spectroscopy, first-principles calculations, and x-ray diffraction K Kamali, TR Ravindran, C Ravi, Y Sorb, N Subramanian, AK Arora Physical Review B 86 (14), 144301, 2012 | 38 | 2012 |

First-principles calculation of phase equilibrium of V-Nb, V-Ta, and Nb-Ta alloys C Ravi, BK Panigrahi, MC Valsakumar, A van de Walle Physical Review B 85 (5), 054202, 2012 | 38 | 2012 |

First-principles study of phase equilibrium in Ti–V, Ti–Nb, and Ti–Ta alloys R Chinnappan, BK Panigrahi, A van de Walle Calphad 54, 125-133, 2016 | 34 | 2016 |

Solvus boundaries of (meta) stable phases in the Al–Mg–Si system: First-principles phonon calculations and thermodynamic modeling H Zhang, Y Wang, SL Shang, C Ravi, C Wolverton, LQ Chen, ZK Liu Calphad 34 (1), 20-25, 2010 | 34 | 2010 |

First-principles study of ground-state properties and phase stability of vanadium nitrides C Ravi Calphad 33 (3), 469-477, 2009 | 28 | 2009 |

Cluster expansion Monte Carlo study of phase stability of vanadium nitrides C Ravi, HK Sahu, MC Valsakumar, A van de Walle Physical Review B 81 (10), 104111, 2010 | 26 | 2010 |

Comparison of thermodynamic databases for 3xx and 6xxx aluminum alloys C Ravi, C Wolverton Metallurgical and Materials Transactions A 36 (8), 2013-2023, 2005 | 26 | 2005 |

Linear Compressibility and Thermal Expansion of KMn[Ag(CN)_{2}]_{3} Studied by Raman Spectroscopy and First-Principles CalculationsK Kamali, C Ravi, TR Ravindran, RM Sarguna, TN Sairam, G Kaur The Journal of Physical Chemistry C 117 (48), 25704-25713, 2013 | 18 | 2013 |

First-principles study of interaction energies of atomic defects in bcc ferromagnetic iron EA Devi, R Chinnappan, CS Sundar Physical Review B 98 (14), 144104, 2018 | 13 | 2018 |

Site preference of Zr in Ti3Al and phase stability of Ti2ZrAl C Ravi, R Asokamani Bulletin of Materials Science 26 (1), 97-103, 2003 | 12 | 2003 |

Properties of solids under high pressure—An electronic band structure approach R Asokamani, C Ravi Bulletin of Materials Science 22 (3), 301-305, 1999 | 9 | 1999 |

First-principles study of lattice stability of ReO3-type hypothetical TaO3 C Ravi, G Kaur, A Bharathi Computational materials science 90, 177-181, 2014 | 7 | 2014 |

Phase stability of V–Ta alloy using cluster expansion and Monte Carlo techniques R Chinnappan Calphad 39, 33-36, 2012 | 6 | 2012 |

Comparative Raman spectroscopic study of phase stability and anharmonic effects in AZr2 (PO4) 3 (A= K, Rb and Cs) K Kamali, TR Ravindran, C Ravi Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 155, 38-46, 2016 | 5 | 2016 |