Density functional theory based screening of ternary alkali-transition metal borohydrides: A computational material design project

  1. Hummelshøj, J.S.
  2. Landis, D.D.
  3. Voss, J.
  4. Jiang, T.
  5. Tekin, A.
  6. Bork, N.
  7. Duak, M.
  8. Mortensen, J.J.
  9. Adamska, L.
  10. Andersin, J.
  11. Baran, J.D.
  12. Barmparis, G.D.
  13. Bell, F.
  14. Bezanilla, A.L.
  15. Bjork, J.
  16. Björketun, M.E.
  17. Bleken, F.
  18. Buchter, F.
  19. Bürkle, M.
  20. Burton, P.D.
  21. Buus, B.B.
  22. Calborean, A.
  23. Calle-Vallejo, F.
  24. Casolo, S.
  25. Chandler, B.D.
  26. Chi, D.H.
  27. Czekaj, I.
  28. Datta, S.
  29. Datye, A.
  30. Delariva, A.
  31. Despoja, V.
  32. Dobrin, S.
  33. Engelund, M.
  34. Ferrighi, L.
  35. Frondelius, P.
  36. Fu, Q.
  37. Fuentes, A.
  38. Fürst, J.
  39. García-Fuente, A.
  40. Gavnholt, J.
  41. Goeke, R.
  42. Gudmundsdottir, S.
  43. Hammond, K.D.
  44. Hansen, H.A.
  45. Hibbitts, D.
  46. Hobi, E.
  47. Howalt, J.G.
  48. Hruby, S.L.
  49. Huth, A.
  50. Isaeva, L.
  51. Jelic, J.
  52. Jensen, I.J.T.
  53. Kacprzak, K.A.
  54. Kelkkanen, A.
  55. Kelsey, D.
  56. Kesanakurthi, D.S.
  57. Kleis, J.
  58. Klüpfel, P.J.
  59. Konstantinov, I.
  60. Korytar, R.
  61. Koskinen, P.
  62. Krishna, C.
  63. Kunkes, E.
  64. Larsen, A.H.
  65. Lastra, J.M.G.
  66. Lin, H.
  67. Lopez-Acevedo, O.
  68. Mantega, M.
  69. Martínez, J.I.
  70. Mesa, I.N.
  71. Mowbray, D.J.
  72. Mrdal, J.S.G.
  73. Natanzon, Y.
  74. Nistor, A.
  75. Olsen, T.
  76. Park, H.
  77. Pedroza, L.S.
  78. Petzold, V.
  79. Plaisance, C.
  80. Rasmussen, J.A.
  81. Ren, H.
  82. Rizzi, M.
  83. Ronco, A.S.
  84. Rostgaard, C.
  85. Saadi, S.
  86. Salguero, L.A.
  87. Santos, E.J.G.
  88. Schoenhalz, A.L.
  89. Shen, J.
  90. Smedemand, M.
  91. Stausholm-Møller, O.J.
  92. Stibius, M.
  93. Strange, M.
  94. Su, H.B.
  95. Temel, B.
  96. Toftelund, A.
  97. Tripkovic, V.
  98. Vanin, M.
  99. Viswanathan, V.
  100. Vojvodic, A.
  101. Wang, S.
  102. Wellendorff, J.
  103. Thygesen, K.S.
  104. Rossmeisl, J.
  105. Bligaard, T.
  106. Jacobsen, K.W.
  107. Nørskov, J.K.
  108. Vegge, T.
  109. Show all authors +
Journal:
Journal of Chemical Physics

ISSN: 0021-9606

Year of publication: 2009

Volume: 131

Issue: 1

Type: Article

DOI: 10.1063/1.3148892 GOOGLE SCHOLAR lock_openOpen access editor
Data source: Scopus