| Approximating q-order reduced density matrices in terms of the lower-order ones. II. Applications FCC Valdemoro Phys. Rev. A 47, 979, 1993 | 241 | 1993 |
| Approximating q-order reduced density matrices in terms of the lower-order ones. I. General relations CV F. Colmenero, C. Pérez del Valle Phys. Rev. A 47, 971, 1993 | 172 | 1993 |
| Self‐consistent approximate solution of the second‐order contracted Schröudinger equation F Colmenero, C Valdemoro International journal of quantum chemistry 51 (6), 369-388, 1994 | 133 | 1994 |
| Mechanical properties of anhydrous oxalic acid and oxalic acid dihydrate F Colmenero Physical Chemistry Chemical Physics 21 (5), 2673-2690, 2019 | 59 | 2019 |
| Periodic density functional theory study of the structure, Raman spectrum, and mechanical properties of Schoepite mineral F Colmenero, J Cobos, V Timón Inorganic Chemistry 57 (8), 4470-4481, 2018 | 58 | 2018 |
| Study of the thermal stability of studtite by in situ Raman spectroscopy and DFT calculations F Colmenero, LJ Bonales, J Cobos, V Timón Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 174, 245-253, 2017 | 56 | 2017 |
| Density Functional Theory Study of the Thermodynamic and Raman Vibrational Properties of γ-UO3 Polymorph F Colmenero, LJ Bonales, J Cobos, V Timón The Journal of Physical Chemistry C 121 (27), 14507-14516, 2017 | 55 | 2017 |
| Spectroscopic Raman characterization of rutherfordine: a combined DFT and experimental study LJ Bonales, F Colmenero, J Cobos, V Timón Physical Chemistry Chemical Physics 18 (24), 16575-16584, 2016 | 53 | 2016 |
| Thermodynamic and mechanical properties of the rutherfordine mineral based on density functional theory F Colmenero, LJ Bonales, J Cobos, V Timón The Journal of Physical Chemistry C 121 (11), 5994-6001, 2017 | 46 | 2017 |
| Structural, mechanical and vibrational study of uranyl silicate mineral soddyite by DFT calculations F Colmenero, LJ Bonales, J Cobos, V Timón Journal of Solid State Chemistry 253, 249-257, 2017 | 43 | 2017 |
| Becquerelite mineral phase: crystal structure and thermodynamic and mechanical stability by using periodic DFT F Colmenero, AM Fernández, V Timón, J Cobos RSC advances 8 (43), 24599-24616, 2018 | 41 | 2018 |
| Thermodynamic properties of uranyl-containing materials based on density functional theory F Colmenero, AM Fernández, J Cobos, V Timón The Journal of Physical Chemistry C 122 (10), 5254-5267, 2018 | 39 | 2018 |
| Temperature-dependent Gibbs free energies of reaction of uranyl-containing materials based on density functional theory F Colmenero, AM Fernández, J Cobos, V Timón The Journal of Physical Chemistry C 122 (10), 5268-5279, 2018 | 39 | 2018 |
| Organic acids under pressure: Elastic properties, negative mechanical phenomena and pressure induced phase transitions in the lactic, maleic, succinic and citric acids F Colmenero Materials Advances 1 (5), 1399-1426, 2020 | 34 | 2020 |
| Anomalous mechanical behavior of the deltic, squaric and croconic cyclic oxocarbon acids F Colmenero Materials Research Express 6 (4), 045610, 2019 | 33 | 2019 |
| Study of the structural, vibrational and thermodynamic properties of natroxalate mineral using density functional theory F Colmenero, V Timón Journal of Solid State Chemistry 263, 131-140, 2018 | 32 | 2018 |
| Periodic DFT study of the thermodynamic properties and stability of schoepite and metaschoepite mineral phases F Colmenero, AM Fernández, J Cobos, V Timón ACS Earth and Space Chemistry 3 (1), 17-28, 2018 | 28 | 2018 |
| Silver oxalate: Mechanical properties and extreme negative mechanical phenomena F Colmenero Advanced Theory and Simulations 2 (6), 1900040, 2019 | 27 | 2019 |
| Crystal structure, hydrogen bonding, mechanical properties and Raman spectrum of the lead uranyl silicate monohydrate mineral kasolite F Colmenero, J Plášil, J Cobos, J Sejkora, V Timón, J Čejka, LJ Bonales RSC advances 9 (27), 15323-15334, 2019 | 26 | 2019 |
| The layered uranyl silicate mineral uranophane-β: Crystal structure, mechanical properties, Raman spectrum and comparison with the α-polymorph F Colmenero, J Plášil, J Sejkora Dalton Transactions 48 (44), 16722-16736, 2019 | 26 | 2019 |
